Bisphenol A

Bisphenol A

CAS 80-05-7  ·  C15H16O2  ·  MW 228.29 g/mol

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3D model Bisphenol A, CAS 80-05-7, molecular formula C15H16O2, molar mass 228.29 g/mol
About Bisphenol A

Bisphenol A is a chemical compound registered under number CAS 80-05-7, with the molecular formula C15H16O2, and a molar mass of 228.29 g/mol.

The molecule contains 33 atoms connected by 34 chemical bonds. The full systematic IUPAC name of this compound is 4-[2-(4-hydroxyphenyl)propan-2-yl]phenol. The interactive 3D model above lets you view the spatial arrangement of the atoms — you can rotate it with the mouse, zoom with the scroll wheel, and switch between skeletal / Ball & Stick / Space Fill visualization modes.

In terms of physicochemical properties, the partition coefficient logP = 3.3 (positive value, a lipophilic compound), polar surface area PSA = 40.5 Ų, 2 donors and 2 hydrogen bond acceptors. These parameters are key when assessing bioavailability and interaction with biomolecules.

Chemical data for this compound comes from PubChem (NIH NLM NCBI), one of the world's largest chemical databases. All information is updated automatically and enriched with GHS hazard statement translations compliant with the CLP Regulation (EC 1272/2008). The interactive 3D model and the viewer images are protected by copyright (© MolGod.org) — terms of use: molgod.org/copyright/.

Physicochemical properties
Molecular formulaC15H16O2
Molar mass228.29 g/mol
IUPAC4-[2-(4-hydroxyphenyl)propan-2-yl]phenol
SMILESCC(C)(C1=CC=C(C=C1)O)C2=CC=C(C=C2)O
InChIKeyIISBACLAFKSPIT-UHFFFAOYSA-N
logP (XLogP3)3.3
PSA40.5 Ų
HBD / HBA2 / 2
PubChem CIDCID 6623 ↗
GHS safety

Signal word: Danger

GHS05
GHS05
GHS07
GHS07
GHS08
GHS08
GHS09
GHS09

? — H360F

H335 — May cause respiratory irritation

H318 — Causes serious eye damage

H317 — May cause an allergic skin reaction

H400 — Very toxic to aquatic life

H410 — Very toxic to aquatic life with long lasting effects

Scientific literature

Related literature

20 articles · 11 open access · Sources: PubMed, OpenAlex, Semantic Scholar

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📈 Publication timeline (number of articles: 20)

1982: number of articles 119821987: number of articles 12000: number of articles 12003: number of articles 12005: number of articles 12007: number of articles 220072008: number of articles 22011: number of articles 12021: number of articles 12025: number of articles 22026: number of articles 72026

Bar height = number of articles in a given year. Hover over a bar to see details.

Data from PubMed (NIH NLM), OpenAlex (CC0), Semantic Scholar (AI2). AI Summary generated by Semantic Scholar TLDR. Articles marked with require paid access.

Synonyms
Bisphenol A · 80-05-7 · 2,2-Bis(4-hydroxyphenyl)propane · Bisphenol · Diano · 4,4'-Isopropylidenediphenol · 4,4'-(propane-2,2-diyl)diphenol · Diphenylolpropane · 4,4'-Bisphenol A · 2,2-Bis(p-hydroxyphenyl)propane · Parabis A · DIAN · Rikabanol · Bisphenol-A · Biphenol A
Data sources
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Related molecules
📜 License & provenanceMolGod_License_1
Model
bisphenol A · 80-05-7
InChIKey
IISBACLAFKSPIT-UHFFFAOYSA-N
License & provenance record
bisphenol A (CAS 80-05-7) →
MolGod molecule record
bisphenol A →
Source data
PubChem CID 6623 ↗
Model information
not published yet

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