Substance Name: Bisphenol A
RN: 80-05-7
InChIKey: IISBACLAFKSPIT-UHFFFAOYSA-N

Note

  • Xenoestrogen.

Molecular Formula

  • C15-H16-O2

Molecular Weight

  • 228.289
2D chemical structure of 80-05-7
 

Classification Codes

  • Air Pollutants
  • Air pollutants, occupational
  • Antioxidants
  • Environmental Pollutants
  • Estrogens
  • Estrogens, non-steroidal
  • Free Radical Scavengers
  • Hormones
  • Hormones, Hormone Substitutes, and Hormone Antagonists
  • Mutation data
  • Reproductive Effect
  • Skin / Eye Irritant
  • Tumor data

Names and Synonyms

Results Name

  • Bisphenol A

Name of Substance

  • 4,4'-(1-Methylethylidene)bisphenol
  • 4,4'-Bisphenol A
  • 4,4'-Isopropylidenediphenol
  • Bisphenol A
  • Phenol, 4,4'-(1-methylethylidene)bis-

Synonyms

  • 2,2-(4,4'-Dihydroxydiphenyl)propane
  • 2,2-Bis(4-hydroxyphenyl)propane
  • 2,2-Bis(hydroxyphenyl)propane
  • 2,2-Bis(p-hydroxyphenyl)propane
  • 2,2-Bis-4'-hydroxyfenylpropan
  • 2,2-Bis-4'-hydroxyfenylpropan [Czech]
  • 2,2-Di(4-hydroxyphenyl)propane
  • 2,2-Di(4-phenylol)propane
  • 4,4'-(1-Methylethylidene)bisphenol
  • 4,4'-Bisphenol A
  • 4,4'-Dihydroxydiphenyl-2,2-propane
  • 4,4'-Dihydroxydiphenyldimethylmethane
  • 4,4'-Dihydroxydiphenylpropane
  • 4,4'-Isopropylidene diphenol
  • 4,4'-Isopropylidenebisphenol
  • 4,4'-Isopropylidenediphenol
  • 4-06-00-06717 (Beilstein Handbook Reference)
  • AI3-04009
  • beta,beta'-Bis(p-hydroxyphenyl)propane
  • beta-Di-p-hydroxyphenylpropane
  • Biphenol A
  • Bis(4-hydroxyphenyl) dimethylmethane
  • Bis(4-hydroxyphenyl)dimethylmethane
  • Bis(4-hydroxyphenyl)propane
  • Bisferol A
  • Bisferol A [Czech]
  • Bisphenol
  • Bisphenol A
  • Bisphenol-A
  • BPA
  • BRN 1107700
  • CCRIS 95
  • DIAN
  • Diano
  • Dimethyl bis(p-hydroxyphenyl)methane
  • Dimethylbis(p-hydroxyphenyl)methane
  • Dimethylmethylene-p,p'-diphenol
  • Diphenylolpropane
  • EINECS 201-245-8
  • HSDB 513
  • Ipognox 88
  • Isopropylidenebis(4-hydroxybenzene)
  • NCI-C50635
  • NSC 1767
  • p,p'-Bisphenol A
  • p,p'-Dihydroxydiphenyldimethylmethane
  • p,p'-Dihydroxydiphenylpropane
  • p,p'-Isopropylidenebisphenol
  • p,p'-Isopropylidenediphenol
  • Parabis A
  • Phenol, (1-methylethylidene)bis-
  • Phenol, 4,4'-(1-methylethylidene)bis-
  • Phenol, 4,4'-dimethylmethylenedi-
  • Phenol, 4,4'-isopropylidenedi-
  • Pluracol 245
  • Propane, 2,2-bis(p-hydroxyphenyl)-
  • Rikabanol
  • Ucar bisphenol A
  • Ucar bisphenol HP
  • UNII-MLT3645I99

Systematic Names

  • 4,4' Isopropylidinediphenol
  • 4,4'-Isopropylidenediphenol
  • Bisphenol A
  • Phenol, 4,4'-(1-methylethylidene)bis-
  • Phenol, 4,4'-isopropylidenedi-

Superlist Names

  • 4,4'-Isopropylidenediphenol
  • Bisphenol A
  • Phenol, 4,4'-isopropylidenedi-

Registry Numbers

CAS Registry Number

  • 80-05-7

Other Registry Numbers

  • 137885-53-1
  • 146479-75-6
  • 27360-89-0
  • 28106-82-3
  • 37808-08-5

Related Registry Number

  • 2444-90-8 (di-hydrochloride salt)

System Generated Number

  • 0000080057

Structure Descriptors

InChI

1S/C15H16O2/c1-15(2,11-3-7-13(16)8-4-11)12-5-9-14(17)10-6-12/h3-10,16-17H,1-2H3

InChIKey

IISBACLAFKSPIT-UHFFFAOYSA-N

Smiles

C(c1ccc(O)cc1)(c1ccc(O)cc1)(C)C

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
guinea pig LD50 oral 4gm/kg (4000mg/kg) BEHAVIORAL: ATAXIA

BEHAVIORAL: CONVULSIONS OR EFFECT ON SEIZURE THRESHOLD

AUTONOMIC NERVOUS SYSTEM: OTHER (DIRECT) PARASYMPATHOMIMETIC
Gigiena i Sanitariya. For English translation, see HYSAAV. Vol. 33(7), Pg. 25, 1968.
mammal (species unspecified) LD50 oral 6500mg/kg (6500mg/kg)   "Toxicology of Drugs and Chemicals," Deichmann, W.B., New York, Academic Press, Inc., 1969Vol. -, Pg. 135, 1969.
mouse LC inhalation > 1700mg/m3/2H (1700mg/m3) LUNGS, THORAX, OR RESPIRATION: DYSPNEA

BEHAVIORAL: ATAXIA

BEHAVIORAL: SOMNOLENCE (GENERAL DEPRESSED ACTIVITY)
Toksikologiya Novykh Promyshlennykh Khimicheskikh Veshchestv. Toxicology of New Industrial Chemical Substances. For English translation, see TNICS*. Vol. 2, Pg. 50, 1961.
mouse LD50 intraperitoneal 150mg/kg (150mg/kg)   National Technical Information Service. Vol. AD691-490,
mouse LD50 oral 2400mg/kg (2400mg/kg) BEHAVIORAL: CONVULSIONS OR EFFECT ON SEIZURE THRESHOLD

BEHAVIORAL: ATAXIA

AUTONOMIC NERVOUS SYSTEM: OTHER (DIRECT) PARASYMPATHOMIMETIC
Gigiena i Sanitariya. For English translation, see HYSAAV. Vol. 33(7), Pg. 25, 1968.
mouse LDLo subcutaneous 2500mg/kg (2500mg/kg) LIVER: FATTY LIVER DEGERATION

BEHAVIORAL: SOMNOLENCE (GENERAL DEPRESSED ACTIVITY)
Toksikologiya Novykh Promyshlennykh Khimicheskikh Veshchestv. Toxicology of New Industrial Chemical Substances. For English translation, see TNICS*. Vol. 2, Pg. 50, 1961.
rabbit LD50 oral 2230mg/kg (2230mg/kg)   American Industrial Hygiene Association Journal. Vol. 28, Pg. 301, 1967.
Link to PubMed
rabbit LD50 skin 3mL/kg (3mL/kg)   AMA Archives of Industrial Hygiene and Occupational Medicine. Vol. 4, Pg. 119, 1951.
rat LD50 oral 3250mg/kg (3250mg/kg)   American Industrial Hygiene Association Journal. Vol. 28, Pg. 301, 1967.
Link to PubMed

Physical Properties

Physical Property Value Units Temp (deg C) Source
Melting Point 153 deg C   EXP
log P (octanol-water) 3.32 (none)   EXP
Water Solubility 120 mg/L 25 EXP
Vapor Pressure 3.91E-07 mm Hg 25 EST
Henry's Law Constant 1.00E-11 atm-m3/mole 25 EST
Atmospheric OH Rate Constant 8.06E-11 cm3/molecule-sec 25 EST

Physical property data is provided to ChemIDplus by Syracuse Research Corporation.
See all available property data for this compound, including references.