Benzoyl peroxide (CED0003347)

Record Information
Version1.0
Creation Date2016-05-19 01:34:11 UTC
Update Date2026-05-14 19:02:30 UTC
Accession NumberCHEM004082
Identification
Common NameBenzoyl peroxide
ClassSmall Molecule
Description
Benzoyl peroxide (C14H10O4) is an organic compound with an average molecular weight of 242.23 g/mol. Benzoyl peroxide belongs to the benzoyl peroxides, a subclass of benzene and substituted derivatives within the organic compounds. Industrially, it serves as an oxidizing agent, catalyst, hardener, inhibitor, dye, food preservative, adhesion/cohesion promoter, and chemical reaction regulator (PMC13351510). In the context of plastics, it is used in polyethylene terephthalate, polystyrene, expanded polystyrene, and low-density polyethylene. The compound is found in or released from 41 recorded sources. These include building and construction materials such as floors, ceilings, tents or canopies, and ladders, stairs and ramps; electrical and electronic equipment including antennas, amplifiers, adjustable resistors, coils, and auxiliary devices; and household cleaning and consumer products such as bleaching agents, soap detergents, perfumes within detergents and soaps, cigar cigarettes, and tobacco smoke filters. Additionally, it is associated with drinking water and water supply, as well as food processing and cookware, specifically the preparation of wort, fermentation processes for beer, processing meats, and food preservation. In healthcare, pharmaceuticals, and veterinary products, it is used in anti-acne preparations. Exposure routes for benzoyl peroxide include transdermal, topical, and oral pathways. It is used as a treatment for acne (PMC8197201). Regarding its biological activity, there are 20 recorded protein targets, which include protein kinase C beta type (PRKCB), protein kinase C gamma type (PRKCG), antizyme inhibitor 2 (AZIN2), and acting as an activator/inhibitor of catalase (CAT), among 16 other proteins.
Contaminant TypeNot Available
Chemical Structure
Synonyms
ValueSource
BepioKegg
Abcat 40HMDB
Abcure S-40-25HMDB
AcetoxylHMDB
AcetOxyl 2.5 and 5HMDB
AcnegelHMDB
Akneroxid 5HMDB
Akneroxid LHMDB
Akneroxide LHMDB
Aksil 5HMDB
AsidopanHMDB
Aztec benzoyl peroxide-70-77HMDB
Aztec benzoyl peroxide-dryHMDB
Aztec bpoHMDB
Benbel cHMDB
Benox 50HMDB
BenoxylHMDB
Benoxyl (5&10) lotionHMDB
BenzacHMDB
Benzac WHMDB
BenzagelHMDB
Benzagel 10HMDB
BenzaknenHMDB
BenzaknewHMDB
BenzamycinHMDB
BenzashaveHMDB
Benzoic acid, peroxideHMDB
Benzol peroxideHMDB
BenzoperoxideHMDB
BenzoylHMDB
Benzoyl peroideHMDB
Benzoyl peroxide (luperox(R) a70S)HMDB
Benzoyl peroxide (luperox(R) a75)HMDB
Benzoyl peroxide (luperox(R) a75fp)HMDB
Benzoyl peroxide (luperox(R) a98)HMDB
Benzoyl peroxide(usan)HMDB
Benzoyl peroxide, blend in dibutyl phthalateHMDB
Benzoyl peroxide, blend in tricresyl phosphateHMDB
Benzoyl peroxide, usanHMDB
Benzoyl superoxideHMDB
BenzoylperoxidHMDB
BenzoylperoxydeHMDB
BPOHMDB
BrevoxylHMDB
Cadat bpoHMDB
CadetHMDB
Cadet bpo-70WHMDB
CadoxHMDB
Cadox 40EHMDB
Cadox bHMDB
Cadox b 40EHMDB
Cadox b 50PHMDB
Cadox b 70WHMDB
Cadox b-CH 50HMDB
Cadox bpo-w40HMDB
Cadox BSHMDB
Cadox btaHMDB
Cadox BTW-50HMDB
Chaloxyd BP 50FTHMDB
Clear by designHMDB
Clearasil antibacterial acne lotionHMDB
Clearasil benzoyl peroxide lotionHMDB
Clearasil BP acne treatmentHMDB
DebroxideHMDB
DermoxylHMDB
DesandenHMDB
Desquam eHMDB
Desquam XHMDB
Desquam-XHMDB
DibenzoylperoxidHMDB
DibenzoylperoxydeHMDB
Diphenylglyoxal peroxideHMDB
Diphenylglyoxal superoxideHMDB
DiphenylperoxyanhydrideHMDB
DRY and clearHMDB
Duresthin 5HMDB
EloxylHMDB
Epi clear antiseptic lotionHMDB
Epi-clearHMDB
FloroxHMDB
Fostex bpoHMDB
GaroxHMDB
IncidolHMDB
LoroxideHMDB
LucidolHMDB
Lucidol (peroxide)HMDB
Lucidol 50PHMDB
Lucidol 75fpHMDB
Lucidol b 50HMDB
Lucidol g 20HMDB
Lucidol GSHMDB
Lucidol KL 50HMDB
Lucidol RMHMDB
Lucidol-70HMDB
Lucidol-78HMDB
LuciliteHMDB
LucipalHMDB
LupercoHMDB
Luperco aHMDB
Luperco aaHMDB
Luperco acHMDB
Luperco afrHMDB
Luperco afr-250HMDB
Luperco astHMDB
Luperox a98HMDB
Luperox FLHMDB
LuzidolHMDB
Mixture OF dibenzoyl peroxide and calcium sulfateHMDB
Mixture OF dibenzoyl peroxide and calcium sulphateHMDB
MytolacHMDB
Nayper b and boHMDB
Nayper boHMDB
NericurHMDB
Norox BZP-250HMDB
Norox BZP-C-35HMDB
NovadeioxHMDB
NovadeloxHMDB
NSC 675HMDB
Oxy 5HMDB
Oxy washHMDB
Oxy-10 coverHMDB
Oxy-5HMDB
Oxy-LHMDB
OxyliteHMDB
PanoxylHMDB
PeriygelHMDB
Perossido di benzoileHMDB
Peroxide, benzoylHMDB
Peroxide, dibenzoylHMDB
Peroxyde de benzoyleHMDB
PeroxydermHMDB
PeroxydexHMDB
Persa-gelHMDB
PersadoxHMDB
Phisoac BPHMDB
PreoxydexHMDB
PresadoxHMDB
Quinolor compoundHMDB
Resdan akneHMDB
SanoxitHMDB
Silica hydrogelHMDB
Stri-dex b.pHMDB
Stri-dex b.p.HMDB
SulfoxylHMDB
SuperoxHMDB
Superox 744HMDB
Superoxide, benzoylHMDB
Superoxide, diphenylglyoxalHMDB
ThermadermHMDB
TopexHMDB
VanoxideHMDB
XeracHMDB
Xerac BPHMDB
Xerac BP 10HMDB
Xerac BP 5HMDB
Dibenzoyl peroxideHMDB
Chemical FormulaC14H10O4
Average Molecular Mass242.227 g/mol
Monoisotopic Mass242.058 g/mol
CAS Registry Number94-36-0
IUPAC Namebenzoyl benzenecarboperoxoate
Traditional Namefostex
SMILESO=C(OOC(=O)C1=CC=CC=C1)C1=CC=CC=C1
InChI IdentifierInChI=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
Biological Properties
StatusDetected and Not Quantified
OriginNot Available
Cellular LocationsNot Available
Biofluid LocationsNot Available
Tissue LocationsNot Available
ApplicationsNot Available
Biological RolesNot Available
Chemical RolesNot Available
Organoleptic EffectsNot Available
Physical Properties
StateNot Available
AppearanceNot Available
Experimental Properties
PropertyValue
Melting PointNot Available
Boiling PointNot Available
SolubilityNot Available
Predicted Properties
PropertyValueSource
Water Solubility0.029 g/LALOGPS
logP2.75ALOGPS
logP3.95ChemAxon
logS-3.9ALOGPS
pKa (Strongest Basic)-7.2ChemAxon
Physiological Charge0ChemAxon
Hydrogen Acceptor Count2ChemAxon
Hydrogen Donor Count0ChemAxon
Polar Surface Area52.6 ŲChemAxon
Rotatable Bond Count5ChemAxon
Refractivity64.77 m³·mol⁻¹ChemAxon
Polarizability24.16 ųChemAxon
Number of Rings2ChemAxon
BioavailabilityYesChemAxon
Rule of FiveYesChemAxon
Ghose FilterYesChemAxon
Veber's RuleNoChemAxon
MDDR-like RuleNoChemAxon
Spectra
Spectra
Spectrum TypeDescriptionSplash KeyDeposition DateView
Predicted GC-MSPredicted GC-MS Spectrumsplash10-0a4i-0900000000-423d9df6ef4f9ce5a079Not AvailableView Spectrum
Predicted GC-MSPredicted GC-MS SpectrumNot AvailableNot AvailableView Spectrum
Predicted GC-MSPredicted GC-MS SpectrumNot AvailableNot AvailableView Spectrum
Predicted LC-MS/MSPredicted LC-MS/MS Spectrumsplash10-0006-0390000000-50998e66fa2f7bef20e1Not AvailableView Spectrum
Predicted LC-MS/MSPredicted LC-MS/MS Spectrumsplash10-0a4i-0920000000-e7246fd3375ad32b63a9Not AvailableView Spectrum
Predicted LC-MS/MSPredicted LC-MS/MS Spectrumsplash10-0a4i-4900000000-584b69634dd12fe901d3Not AvailableView Spectrum
Predicted LC-MS/MSPredicted LC-MS/MS Spectrumsplash10-0006-0090000000-31279cde2ca79ff16285Not AvailableView Spectrum
Predicted LC-MS/MSPredicted LC-MS/MS Spectrumsplash10-0006-0290000000-9bcc1591e9874715a701Not AvailableView Spectrum
Predicted LC-MS/MSPredicted LC-MS/MS Spectrumsplash10-0udi-3930000000-ac2e3837cbd47bd6015dNot AvailableView Spectrum
Predicted LC-MS/MSPredicted LC-MS/MS Spectrumsplash10-0a4l-0980000000-c0b8b681a6b292a33c25Not AvailableView Spectrum
Predicted LC-MS/MSPredicted LC-MS/MS Spectrumsplash10-0a4i-0900000000-488d41e3a0b2e5a9eb49Not AvailableView Spectrum
Predicted LC-MS/MSPredicted LC-MS/MS Spectrumsplash10-0a4i-2900000000-2602e3f446e8009ad5fdNot AvailableView Spectrum
Predicted LC-MS/MSPredicted LC-MS/MS Spectrumsplash10-0006-0090000000-871b46014990fc059dacNot AvailableView Spectrum
Predicted LC-MS/MSPredicted LC-MS/MS Spectrumsplash10-0006-0090000000-c13c84561286f2b25014Not AvailableView Spectrum
Predicted LC-MS/MSPredicted LC-MS/MS Spectrumsplash10-004i-9000000000-f83e28014dc1944fb49aNot AvailableView Spectrum
Toxicity Profile
Mechanism of ToxicityNot Available
Carcinogenicity (IARC Classification)Not Available
Minimum Risk LevelNot Available
SymptomsNot Available
TreatmentNot Available
Toxicity Values
Toxicity ValueUnitValue RangeOrganismDose DescriptorRoute of ExposurePredicted or ExperimentalReference
6344.0Log mg/kg[3600:11000]RatLD50oralpredictedNot Available
Health Effects
Health EffectRelationshipDirectionReference
Acneis_treatment_forNot AvailablePMC8197201
Exposure Sources
Source IDSourceSectorReference
10InsecticidesAgriculture & land managementNot Available
115Drinking waterDrinking water & water supplyNot Available
233BrushesPersonal care & cosmeticsNot Available
314Anti-acne preparationsHealthcare, pharmaceuticals & veterinary productsNot Available
495CeilingsBuilding & ConstructionNot Available
497FloorsBuilding & ConstructionNot Available
498LaddersBuilding & ConstructionNot Available
500Stairs And RampsBuilding & ConstructionNot Available
503Tents Or CanopiesBuilding & ConstructionNot Available
504Adjustable ResistorsElectrical & Electronic EquipmentNot Available
505AmplifiersElectrical & Electronic EquipmentNot Available
506AntennasElectrical & Electronic EquipmentNot Available
507Auxiliary DevicesElectrical & Electronic EquipmentNot Available
508CoilsElectrical & Electronic EquipmentNot Available
510Communication Cables Or ConductorsElectrical & Electronic EquipmentNot Available
511Conductors Or Conductive Bodies Characterised By The Conductive MaterialsElectrical & Electronic EquipmentNot Available
513Cores Yokes Or ArmaturesElectrical & Electronic EquipmentNot Available
514Discharge LampsElectrical & Electronic EquipmentNot Available
516Electric Hearing AidsElectrical & Electronic EquipmentNot Available
517Electric SwitchesElectrical & Electronic EquipmentNot Available
518Electrically Stimulated Smoking DevicesElectrical & Electronic EquipmentNot Available
519ElectrodesElectrical & Electronic EquipmentNot Available
520Emergency Protective DevicesElectrical & Electronic EquipmentNot Available
521Fixed Capacitors And Their ManufactureElectrical & Electronic EquipmentNot Available
524Hybrid CapacitorsElectrical & Electronic EquipmentNot Available
525Line Transmission SystemsElectrical & Electronic EquipmentNot Available
526LoudspeakersElectrical & Electronic EquipmentNot Available
527MagnetsElectrical & Electronic EquipmentNot Available
529Power CablesElectrical & Electronic EquipmentNot Available
530Radio Transmission SystemsElectrical & Electronic EquipmentNot Available
531RelaysElectrical & Electronic EquipmentNot Available
533Sparking PlugsElectrical & Electronic EquipmentNot Available
535Superconducting Magnets And Superconducting CoilsElectrical & Electronic EquipmentNot Available
537Television SystemsElectrical & Electronic EquipmentNot Available
544Fermentation Processes For BeerFood, food processing & cookwareNot Available
545Food PreservationFood, food processing & cookwareNot Available
550Preparation Of WortFood, food processing & cookwareNot Available
552Processing MeatsFood, food processing & cookwareNot Available
555Bleaching AgentsHousehold cleaning & consumer productsNot Available
556Cigar CigarettesHousehold cleaning & consumer productsNot Available
561Perfumes Within Detergents And SoapsHousehold cleaning & consumer productsNot Available
563Soap DetergentsHousehold cleaning & consumer productsNot Available
569Tobacco Smoke FiltersHousehold cleaning & consumer productsNot Available
579Manufacture Of Iron Or SteelIndustrial manufacturing & chemical processingNot Available
580Manufacture Preparation Of Tobacco ProductsIndustrial manufacturing & chemical processingNot Available
581Paper Making MachinesIndustrial manufacturing & chemical processingNot Available
584BuoysMarine, shipping & aquacultureNot Available
589Life BuoysMarine, shipping & aquacultureNot Available
592Marine Propulsion Or SteeringMarine, shipping & aquacultureNot Available
596AcaricidesAgriculture & land managementNot Available
600Herbicides And AlgicidesAgriculture & land managementNot Available
602MolluscicidesAgriculture & land managementNot Available
604Pest AttractantsAgriculture & land managementNot Available
605Pest RepellantsAgriculture & land managementNot Available
606Plant Growth RegulatorsAgriculture & land managementNot Available
609AftershavePersonal care & cosmeticsNot Available
610Aftersun ProductsPersonal care & cosmeticsNot Available
611Anti Perspirants Or Body DeoderantsPersonal care & cosmeticsNot Available
612Body Washing Or Cleaning ImplementsPersonal care & cosmeticsNot Available
613DepilatoriesPersonal care & cosmeticsNot Available
614Essential Oils Or PerfumesPersonal care & cosmeticsNot Available
615Eye Makeup ProductsPersonal care & cosmeticsNot Available
616Face Mask CosmeticsPersonal care & cosmeticsNot Available
617Lip Care ProductsPersonal care & cosmeticsNot Available
618Lip Makeup ProductsPersonal care & cosmeticsNot Available
619Manicure PedicurePersonal care & cosmeticsNot Available
630ToysRecreation & sports surfacesNot Available
632ApparelTextiles, leather & furnishingsNot Available
633Azo DyesTextiles, leather & furnishingsNot Available
635ButtonsTextiles, leather & furnishingsNot Available
638Decorating TextilesTextiles, leather & furnishingsNot Available
640Embroidering And TuftingTextiles, leather & furnishingsNot Available
641Foam DyeingTextiles, leather & furnishingsNot Available
642FootwearTextiles, leather & furnishingsNot Available
643HeadwearTextiles, leather & furnishingsNot Available
647Multicolour DyeingTextiles, leather & furnishingsNot Available
648Nitro DyesTextiles, leather & furnishingsNot Available
650Purses Luggage Hand BagsTextiles, leather & furnishingsNot Available
652RopesTextiles, leather & furnishingsNot Available
657Surface Finishing Of LeatherTextiles, leather & furnishingsNot Available
658Touch FastenersTextiles, leather & furnishingsNot Available
659Transfer PrintingTextiles, leather & furnishingsNot Available
661UmbrellasTextiles, leather & furnishingsNot Available
662Yarns Or ThreadsTextiles, leather & furnishingsNot Available
Pathways
1 pathway
Targets
StructureProteinUniProt IDOrganismRelationshipDetails
Click to view 3D structureSortase AQ8CM62Streptococcus mutansPredicted (SEA)3.50322
Carbonic anhydrase 12 structureClick to view 3D structureCarbonic anhydrase 12O43570HumansPredicted (SEA)55.5065
Click to view 3D structureCocaine esteraseO00748HumansPredicted (SEA)1.32344
Liver carboxylesterase 1 structureClick to view 3D structureLiver carboxylesterase 1P23141HumansPredicted (SEA)7.39568
Click to view 3D structureLiver carboxylesterase 1P12337Oryctolagus cuniculusPredicted (SEA)0.311397
Carbonic anhydrase 2 structureClick to view 3D structureCarbonic anhydrase 2P00918HumansPredicted (SEA)115.45
Nicotinate phosphoribosyltransferase structureClick to view 3D structureNicotinate phosphoribosyltransferaseQ6XQN6HumansPredicted (SEA)0.778492
Carbonic anhydrase 1 structureClick to view 3D structureCarbonic anhydrase 1P00915HumansPredicted (SEA)104.941
Carbonic anhydrase 9 structureClick to view 3D structureCarbonic anhydrase 9Q16790HumansPredicted (SEA)98.1679
Protein deacetylase HDAC6 structureClick to view 3D structureProtein deacetylase HDAC6Q9UBN7HumansPredicted (SEA)196.725
Histone deacetylase 1 structureClick to view 3D structureHistone deacetylase 1Q13547HumansPredicted (SEA)230.667
Click to view 3D structureLuciferin 4-monooxygenaseP08659Photinus pyralisPredicted (SEA)24.5225
Amine oxidase [flavin-containing] B structureClick to view 3D structureAmine oxidase [flavin-containing] BP27338HumansPredicted (SEA)157.723
Click to view 3D structureMitochondrial import inner membrane translocase subunit TIM23P32897Saccharomyces cerevisiae S288cPredicted (SEA)13.0787
Click to view 3D structureAcetylcholine-binding proteinP58154Lymnaea stagnalisPredicted (SEA)4.5931
Histone deacetylase 2 structureClick to view 3D structureHistone deacetylase 2Q92769HumansPredicted (SEA)192.677
Carbonic anhydrase 6 structureClick to view 3D structureCarbonic anhydrase 6P23280HumansPredicted (SEA)65.0041
Cytochrome P450 1B1 structureClick to view 3D structureCytochrome P450 1B1Q16678HumansPredicted (SEA)46.5538
Cytochrome P450 3A4 structureClick to view 3D structureCytochrome P450 3A4P08684HumansPredicted (SEA)903.752
Click to view 3D structureHeat shock factor protein 1P38532Mus musculusPredicted (SEA)33.1638
Metabotropic glutamate receptor 5 structureClick to view 3D structureMetabotropic glutamate receptor 5P41594HumansPredicted (SEA)17.5161
Carbonic anhydrase 7 structureClick to view 3D structureCarbonic anhydrase 7P43166HumansPredicted (SEA)118.331
Click to view 3D structureSodium-dependent dopamine transporterP23977Rattus norvegicusPredicted (SEA)114.283
Histone deacetylase 8 structureClick to view 3D structureHistone deacetylase 8Q9BY41HumansPredicted (SEA)227.164
D-amino-acid oxidase structureClick to view 3D structureD-amino-acid oxidaseP14920HumansPredicted (SEA)4.7488
Concentrations
Not Available
External Links
DrugBank IDDB09096
HMDB IDHMDB0032040
FooDB IDFDB008743
Phenol Explorer IDNot Available
KNApSAcK IDNot Available
BiGG IDNot Available
BioCyc IDNot Available
METLIN IDNot Available
PDB IDNot Available
Wikipedia LinkBenzoyl peroxide
Chemspider ID6919
ChEBI IDNot Available
PubChem Compound ID7187
Kegg Compound IDC19346
YMDB IDNot Available
ECMDB IDNot Available
References
Synthesis ReferenceNot Available
MSDSNot 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.
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.
3. Angelini G, Vena GA, Meneghini CL: Allergic contact dermatitis to some medicaments. Contact Dermatitis. 1985 May;12(5):263-9.
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.
5. Dreno B: Topical antibacterial therapy for acne vulgaris. Drugs. 2004;64(21):2389-97.
6. Yannai, Shmuel. (2004) Dictionary of food compounds with CD-ROM: Additives, flavors, and ingredients. Boca Raton: Chapman & Hall/CRC.