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Showing metabocard for Benzoyl peroxide (HMDB0032040)

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Record Information
Version5.0
StatusExpected but not Quantified
Creation Date2012-09-11 17:47:24 UTC
Update Date2022-03-07 02:53:13 UTC
HMDB IDHMDB0032040
Secondary Accession Numbers
  • HMDB32040
Metabolite Identification
Common NameBenzoyl peroxide
DescriptionBenzoyl peroxide is found in cereals and cereal products. Added to bread and cheese as bleaching agent Benzoyl peroxide is an organic compound in the organic peroxide family. It consists of two benzoyl groups joined by a peroxide group. Its structural formula is [C6H5-C(O)]2O2. It is one of the most important organic peroxides in terms of applications and the scale of its production. Benzoyl peroxide is used as an acne treatment, for improving flour, for bleaching hair and teeth, for polymerising polyester and many other uses. In the U. S., the typical concentration for benzoyl peroxide is 2.5% to 10% for both prescription and over the counter preparations that are used in treatment for acne. Higher concentrations are used for hair bleach and teeth whitening. Benzoyl peroxide, like most peroxides, is a powerful bleaching agent. Contact with fabrics or hair can cause permanent color dampening almost immediately. Even secondary contact can cause bleaching. For example, contact with a towel that has been used to wash off benzoyl peroxide-containing hygiene products.[citation needed
Structure
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MOL3D MOLSDF3D SDFPDB3D PDBSMILESInChI

MOL for HMDB0032040 (Benzoyl peroxide)

  Mrv0541 05061306192D          

 18 19  0  0  0  0            999 V2000
    0.0000    3.3000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.4302    1.2375    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000    2.4750    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.7145    3.7125    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.4302    2.0625    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.7158    0.8250    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.7145    2.0625    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.4289    3.3000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.7158    2.4750    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.0013    1.2375    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.4289    2.4750    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.0013    2.0625    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.1434    2.0625    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.2868    2.4750    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.1434    1.2375    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.2868    3.3000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.8579    2.4750    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.5724    2.0625    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
  3  1  2  0  0  0  0
  4  1  1  0  0  0  0
  5  2  2  0  0  0  0
  6  2  1  0  0  0  0
  7  3  1  0  0  0  0
  8  4  2  0  0  0  0
  9  5  1  0  0  0  0
 10  6  2  0  0  0  0
 11  7  2  0  0  0  0
 11  8  1  0  0  0  0
 12  9  2  0  0  0  0
 12 10  1  0  0  0  0
 13 11  1  0  0  0  0
 14 12  1  0  0  0  0
 15 13  2  0  0  0  0
 16 14  2  0  0  0  0
 17 13  1  0  0  0  0
 18 14  1  0  0  0  0
 18 17  1  0  0  0  0
M  END
Download

3D MOL for HMDB0032040 (Benzoyl peroxide)

HMDB0032040
     RDKit          3D
Benzoyl peroxide
 28 29  0  0  0  0  0  0  0  0999 V2000
   -1.1160   -1.3522    0.7514 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5553   -0.3082    0.2069 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6667    0.6887   -0.0842 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.6666    0.6290    0.1758 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.6197    0.1816   -0.6930 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2735   -0.2097   -1.8205 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.0260    0.1817   -0.2544 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.0146   -0.2653   -1.1111 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.3401   -0.2731   -0.7184 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.7068    0.1624    0.5306 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.7190    0.6062    1.3793 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.3794    0.6203    0.9984 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.9904   -0.2291   -0.0796 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.5468    0.8844   -0.6757 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.8956    0.9833   -0.9560 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.7411   -0.0630   -0.6353 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.2005   -1.1803   -0.0402 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.8529   -1.2593    0.2310 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.7455   -0.6137   -2.1029 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.1143   -0.6210   -1.3836 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.7365    0.1571    0.8379 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.9713    0.9587    2.3765 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.6005    0.9742    1.6779 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8968    1.6976   -0.9264 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.3488    1.8423   -1.4201 H   0  0  0  0  0  0  0  0  0  0  0  0
   -6.8064   -0.0366   -0.8335 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.8498   -1.9952    0.2112 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.4468   -2.1609    0.7059 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  2  0
  2  3  1  0
  3  4  1  0
  4  5  1  0
  5  6  2  0
  5  7  1  0
  7  8  2  0
  8  9  1  0
  9 10  2  0
 10 11  1  0
 11 12  2  0
  2 13  1  0
 13 14  2  0
 14 15  1  0
 15 16  2  0
 16 17  1  0
 17 18  2  0
 12  7  1  0
 18 13  1  0
  8 19  1  0
  9 20  1  0
 10 21  1  0
 11 22  1  0
 12 23  1  0
 14 24  1  0
 15 25  1  0
 16 26  1  0
 17 27  1  0
 18 28  1  0
M  END
Download

3D SDF for HMDB0032040 (Benzoyl peroxide)

  Mrv0541 05061306192D          

 18 19  0  0  0  0            999 V2000
    0.0000    3.3000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.4302    1.2375    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000    2.4750    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.7145    3.7125    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.4302    2.0625    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.7158    0.8250    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.7145    2.0625    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.4289    3.3000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.7158    2.4750    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.0013    1.2375    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.4289    2.4750    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.0013    2.0625    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.1434    2.0625    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.2868    2.4750    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.1434    1.2375    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.2868    3.3000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.8579    2.4750    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.5724    2.0625    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
  3  1  2  0  0  0  0
  4  1  1  0  0  0  0
  5  2  2  0  0  0  0
  6  2  1  0  0  0  0
  7  3  1  0  0  0  0
  8  4  2  0  0  0  0
  9  5  1  0  0  0  0
 10  6  2  0  0  0  0
 11  7  2  0  0  0  0
 11  8  1  0  0  0  0
 12  9  2  0  0  0  0
 12 10  1  0  0  0  0
 13 11  1  0  0  0  0
 14 12  1  0  0  0  0
 15 13  2  0  0  0  0
 16 14  2  0  0  0  0
 17 13  1  0  0  0  0
 18 14  1  0  0  0  0
 18 17  1  0  0  0  0
M  END
> <DATABASE_ID>
HMDB0032040

> <DATABASE_NAME>
hmdb

> <SMILES>
O=C(OOC(=O)C1=CC=CC=C1)C1=CC=CC=C1

> <INCHI_IDENTIFIER>
InChI=1S/C14H10O4/c15-13(11-7-3-1-4-8-11)17-18-14(16)12-9-5-2-6-10-12/h1-10H

> <INCHI_KEY>
OMPJBNCRMGITSC-UHFFFAOYSA-N

> <FORMULA>
C14H10O4

> <MOLECULAR_WEIGHT>
242.2268

> <EXACT_MASS>
242.057908808

> <JCHEM_ACCEPTOR_COUNT>
2

> <JCHEM_AVERAGE_POLARIZABILITY>
24.15778938018316

> <JCHEM_BIOAVAILABILITY>
1

> <JCHEM_DONOR_COUNT>
0

> <JCHEM_FORMAL_CHARGE>
0

> <JCHEM_GHOSE_FILTER>
1

> <JCHEM_IUPAC>
benzoyl benzenecarboperoxoate

> <ALOGPS_LOGP>
2.75

> <JCHEM_LOGP>
3.946932388

> <ALOGPS_LOGS>
-3.92

> <JCHEM_MDDR_LIKE_RULE>
0

> <JCHEM_NUMBER_OF_RINGS>
2

> <JCHEM_PHYSIOLOGICAL_CHARGE>
0

> <JCHEM_PKA_STRONGEST_BASIC>
-7.169419788005589

> <JCHEM_POLAR_SURFACE_AREA>
52.60000000000001

> <JCHEM_REFRACTIVITY>
64.77320000000002

> <JCHEM_ROTATABLE_BOND_COUNT>
5

> <JCHEM_RULE_OF_FIVE>
1

> <ALOGPS_SOLUBILITY>
2.94e-02 g/l

> <JCHEM_TRADITIONAL_IUPAC>
fostex

> <JCHEM_VEBER_RULE>
0

$$$$
Download

3D-SDF for HMDB0032040 (Benzoyl peroxide)

HMDB0032040
     RDKit          3D
Benzoyl peroxide
 28 29  0  0  0  0  0  0  0  0999 V2000
   -1.1160   -1.3522    0.7514 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5553   -0.3082    0.2069 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6667    0.6887   -0.0842 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.6666    0.6290    0.1758 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.6197    0.1816   -0.6930 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2735   -0.2097   -1.8205 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.0260    0.1817   -0.2544 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.0146   -0.2653   -1.1111 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.3401   -0.2731   -0.7184 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.7068    0.1624    0.5306 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.7190    0.6062    1.3793 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.3794    0.6203    0.9984 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.9904   -0.2291   -0.0796 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.5468    0.8844   -0.6757 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.8956    0.9833   -0.9560 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.7411   -0.0630   -0.6353 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.2005   -1.1803   -0.0402 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.8529   -1.2593    0.2310 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.7455   -0.6137   -2.1029 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.1143   -0.6210   -1.3836 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.7365    0.1571    0.8379 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.9713    0.9587    2.3765 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.6005    0.9742    1.6779 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8968    1.6976   -0.9264 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.3488    1.8423   -1.4201 H   0  0  0  0  0  0  0  0  0  0  0  0
   -6.8064   -0.0366   -0.8335 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.8498   -1.9952    0.2112 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.4468   -2.1609    0.7059 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  2  0
  2  3  1  0
  3  4  1  0
  4  5  1  0
  5  6  2  0
  5  7  1  0
  7  8  2  0
  8  9  1  0
  9 10  2  0
 10 11  1  0
 11 12  2  0
  2 13  1  0
 13 14  2  0
 14 15  1  0
 15 16  2  0
 16 17  1  0
 17 18  2  0
 12  7  1  0
 18 13  1  0
  8 19  1  0
  9 20  1  0
 10 21  1  0
 11 22  1  0
 12 23  1  0
 14 24  1  0
 15 25  1  0
 16 26  1  0
 17 27  1  0
 18 28  1  0
M  END
Download

PDB for HMDB0032040 (Benzoyl peroxide)

HEADER    PROTEIN                                 06-MAY-13   NONE
TITLE     NULL                                                        
COMPND    NULL                                                        
SOURCE    NULL                                                        
KEYWDS    NULL                                                        
EXPDTA    NULL                                                        
AUTHOR    Marvin                                                      
REVDAT   1   06-MAY-13         0                                  
HETATM    1  C   UNK     0       0.000   6.160   0.000  0.00  0.00           C+0
HETATM    2  C   UNK     0      12.003   2.310   0.000  0.00  0.00           C+0
HETATM    3  C   UNK     0       0.000   4.620   0.000  0.00  0.00           C+0
HETATM    4  C   UNK     0       1.334   6.930   0.000  0.00  0.00           C+0
HETATM    5  C   UNK     0      12.003   3.850   0.000  0.00  0.00           C+0
HETATM    6  C   UNK     0      10.669   1.540   0.000  0.00  0.00           C+0
HETATM    7  C   UNK     0       1.334   3.850   0.000  0.00  0.00           C+0
HETATM    8  C   UNK     0       2.667   6.160   0.000  0.00  0.00           C+0
HETATM    9  C   UNK     0      10.669   4.620   0.000  0.00  0.00           C+0
HETATM   10  C   UNK     0       9.336   2.310   0.000  0.00  0.00           C+0
HETATM   11  C   UNK     0       2.667   4.620   0.000  0.00  0.00           C+0
HETATM   12  C   UNK     0       9.336   3.850   0.000  0.00  0.00           C+0
HETATM   13  C   UNK     0       4.001   3.850   0.000  0.00  0.00           C+0
HETATM   14  C   UNK     0       8.002   4.620   0.000  0.00  0.00           C+0
HETATM   15  O   UNK     0       4.001   2.310   0.000  0.00  0.00           O+0
HETATM   16  O   UNK     0       8.002   6.160   0.000  0.00  0.00           O+0
HETATM   17  O   UNK     0       5.335   4.620   0.000  0.00  0.00           O+0
HETATM   18  O   UNK     0       6.668   3.850   0.000  0.00  0.00           O+0
CONECT    1    3    4                                                       
CONECT    2    5    6                                                       
CONECT    3    1    7                                                       
CONECT    4    1    8                                                       
CONECT    5    2    9                                                       
CONECT    6    2   10                                                       
CONECT    7    3   11                                                       
CONECT    8    4   11                                                       
CONECT    9    5   12                                                       
CONECT   10    6   12                                                       
CONECT   11    7    8   13                                                  
CONECT   12    9   10   14                                                  
CONECT   13   11   15   17                                                  
CONECT   14   12   16   18                                                  
CONECT   15   13                                                            
CONECT   16   14                                                            
CONECT   17   13   18                                                       
CONECT   18   14   17                                                       
MASTER        0    0    0    0    0    0    0    0   18    0   38    0
END
Download

3D PDB for HMDB0032040 (Benzoyl peroxide)

COMPND    HMDB0032040
HETATM    1  O1  UNL     1      -1.116  -1.352   0.751  1.00  0.00           O  
HETATM    2  C1  UNL     1      -1.555  -0.308   0.207  1.00  0.00           C  
HETATM    3  O2  UNL     1      -0.667   0.689  -0.084  1.00  0.00           O  
HETATM    4  O3  UNL     1       0.667   0.629   0.176  1.00  0.00           O  
HETATM    5  C2  UNL     1       1.620   0.182  -0.693  1.00  0.00           C  
HETATM    6  O4  UNL     1       1.274  -0.210  -1.820  1.00  0.00           O  
HETATM    7  C3  UNL     1       3.026   0.182  -0.254  1.00  0.00           C  
HETATM    8  C4  UNL     1       4.015  -0.265  -1.111  1.00  0.00           C  
HETATM    9  C5  UNL     1       5.340  -0.273  -0.718  1.00  0.00           C  
HETATM   10  C6  UNL     1       5.707   0.162   0.531  1.00  0.00           C  
HETATM   11  C7  UNL     1       4.719   0.606   1.379  1.00  0.00           C  
HETATM   12  C8  UNL     1       3.379   0.620   0.998  1.00  0.00           C  
HETATM   13  C9  UNL     1      -2.990  -0.229  -0.080  1.00  0.00           C  
HETATM   14  C10 UNL     1      -3.547   0.884  -0.676  1.00  0.00           C  
HETATM   15  C11 UNL     1      -4.896   0.983  -0.956  1.00  0.00           C  
HETATM   16  C12 UNL     1      -5.741  -0.063  -0.635  1.00  0.00           C  
HETATM   17  C13 UNL     1      -5.201  -1.180  -0.040  1.00  0.00           C  
HETATM   18  C14 UNL     1      -3.853  -1.259   0.231  1.00  0.00           C  
HETATM   19  H1  UNL     1       3.746  -0.614  -2.103  1.00  0.00           H  
HETATM   20  H2  UNL     1       6.114  -0.621  -1.384  1.00  0.00           H  
HETATM   21  H3  UNL     1       6.737   0.157   0.838  1.00  0.00           H  
HETATM   22  H4  UNL     1       4.971   0.959   2.376  1.00  0.00           H  
HETATM   23  H5  UNL     1       2.600   0.974   1.678  1.00  0.00           H  
HETATM   24  H6  UNL     1      -2.897   1.698  -0.926  1.00  0.00           H  
HETATM   25  H7  UNL     1      -5.349   1.842  -1.420  1.00  0.00           H  
HETATM   26  H8  UNL     1      -6.806  -0.037  -0.833  1.00  0.00           H  
HETATM   27  H9  UNL     1      -5.850  -1.995   0.211  1.00  0.00           H  
HETATM   28  H10 UNL     1      -3.447  -2.161   0.706  1.00  0.00           H  
CONECT    1    2    2
CONECT    2    3   13
CONECT    3    4
CONECT    4    5
CONECT    5    6    6    7
CONECT    7    8    8   12
CONECT    8    9   19
CONECT    9   10   10   20
CONECT   10   11   21
CONECT   11   12   12   22
CONECT   12   23
CONECT   13   14   14   18
CONECT   14   15   24
CONECT   15   16   16   25
CONECT   16   17   26
CONECT   17   18   18   27
CONECT   18   28
END
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SMILES for HMDB0032040 (Benzoyl peroxide)

O=C(OOC(=O)C1=CC=CC=C1)C1=CC=CC=C1
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INCHI for HMDB0032040 (Benzoyl peroxide)

InChI=1S/C14H10O4/c15-13(11-7-3-1-4-8-11)17-18-14(16)12-9-5-2-6-10-12/h1-10H
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View in JSmolView Stereo Labels
Synonyms
Chemical FormulaC14H10O4
Average Molecular Weight242.2268
Monoisotopic Molecular Weight242.057908808
IUPAC Namebenzoyl benzenecarboperoxoate
Traditional Namefostex
CAS Registry Number94-36-0
SMILES
O=C(OOC(=O)C1=CC=CC=C1)C1=CC=CC=C1
InChI Identifier
InChI=1S/C14H10O4/c15-13(11-7-3-1-4-8-11)17-18-14(16)12-9-5-2-6-10-12/h1-10H
InChI KeyOMPJBNCRMGITSC-UHFFFAOYSA-N
Chemical Taxonomy
Description Belongs to the class of organic compounds known as benzoyl peroxides. These are organic compounds containing two benzoyl groups O-linked to each other via a peroxide group. Their skeleton has the general formula [C6H5C(O)]2O2.
KingdomOrganic compounds
Super ClassBenzenoids
ClassBenzene and substituted derivatives
Sub ClassBenzoyl peroxides
Direct ParentBenzoyl peroxides
Alternative Parents
Substituents
  • Benzoyl peroxide
  • Peroxybenzoate
  • Benzoic acid or derivatives
  • Benzoyl
  • Dicarboxylic acid or derivatives
  • Peroxycarboxylic acid or derivatives
  • Carboxylic acid salt
  • Carboxylic acid derivative
  • Organic oxygen compound
  • Organic oxide
  • Hydrocarbon derivative
  • Organic salt
  • Organooxygen compound
  • Aromatic homomonocyclic compound
Molecular FrameworkAromatic homomonocyclic compounds
External Descriptors
Ontology
Physiological effect
Organoleptic effect
Disposition
Biological locationRoute of exposureSource
ProcessNot Available
Role
Industrial applicationBiological role
Physical Properties
StateSolid
Experimental Molecular Properties
PropertyValueReference
Melting Point106 - 108 °CNot Available
Boiling Point349.75 °C. @ 760.00 mm Hg (est)The Good Scents Company Information System
Water Solubility0.0091 mg/mL at 25 °CNot Available
LogP3.46Not Available
Experimental Chromatographic PropertiesNot Available
Predicted Molecular Properties
Predicted Chromatographic Properties
Spectra
Biological Properties
Cellular Locations
  • Membrane
Biospecimen LocationsNot Available
Tissue LocationsNot Available
Pathways
Normal Concentrations
Not Available
Abnormal Concentrations
Not Available
Associated Disorders and Diseases
Disease ReferencesNone
Associated OMIM IDsNone
DrugBank IDDB09096
Phenol Explorer Compound IDNot Available
FooDB IDFDB008743
KNApSAcK IDNot Available
Chemspider ID6919
KEGG Compound IDC19346
BioCyc IDNot Available
BiGG IDNot Available
Wikipedia LinkBenzoyl peroxide
METLIN IDNot Available
PubChem Compound7187
PDB IDNot Available
ChEBI IDNot Available
Food Biomarker OntologyNot Available
VMH IDNot Available
MarkerDB IDNot Available
Good Scents IDrw1097921
References
Synthesis ReferenceNot Available
Material Safety Data Sheet (MSDS)Not Available
General References
  1. Welch SL: Oral toxicity of topical preparations. Vet Clin North Am Small Anim Pract. 2002 Mar;32(2):443-53, vii. [PubMed:12012746 ]
  2. Nacht S, Gans EH, McGinley KJ, Kligman AM: Comparative activity of benzoyl peroxide and hexachlorophene. In vivo studies against propionibacterium acnes in humans. Arch Dermatol. 1983 Jul;119(7):577-9. [PubMed:6222704 ]
  3. Angelini G, Vena GA, Meneghini CL: Allergic contact dermatitis to some medicaments. Contact Dermatitis. 1985 May;12(5):263-9. [PubMed:4028702 ]
  4. Hegemann L, Toso SM, Kitay K, Webster GF: Anti-inflammatory actions of benzoyl peroxide: effects on the generation of reactive oxygen species by leucocytes and the activity of protein kinase C and calmodulin. Br J Dermatol. 1994 May;130(5):569-75. [PubMed:8204465 ]
  5. Dreno B: Topical antibacterial therapy for acne vulgaris. Drugs. 2004;64(21):2389-97. [PubMed:15481998 ]
  6. (). Yannai, Shmuel. (2004) Dictionary of food compounds with CD-ROM: Additives, flavors, and ingredients. Boca Raton: Chapman & Hall/CRC.. .