Basic information
- CAS
14868-03-2- Standard SMILES
Oc1ccc(C(=C(Cl)Cl)c2ccc(O)cc2)cc1- InChIKey
OWEYKIWAZBBXJK-UHFFFAOYSA-N- Molecular formula
- C14H10Cl2O2
- Average molar mass
- 281.1 g/mol
- Monoisotopic mass
- 280.0057849
Names & identifiers
- Preferred name
- 1,1-Bis(4-hydroxyphenyl)-2,2-dichloroethylene
- IUPAC
- 4-[2,2-dichloro-1-(4-hydroxyphenyl)ethenyl]phenol
- English name
- Bisphenol C
- Molecular formula
- C14H10Cl2O2
- Molecular weight
- 281.13
Names & synonyms
Show more names
Database identifiers
- CAS
14868-03-2- PubChem CID
- 84677
- DTXSID
DTXSID5022485- ChEMBL
CHEMBL592305- ChEBI
CHEBI:34030- UNII
- U4668GRX7T
- EC Number
- 238-940-0
- Nikkaji
- J227.221K
Properties
Computed structural properties
- XLogP
- 5
- Topological polar surface area
- 40.5 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 2
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 273
Experimental & physicochemical properties
Physicochemical properties
- Melting point
- 213 · 213-217 °C(lit.)
- Boiling point
- 405 · 405.0±40.0 °C(Predicted)
- Density
- 1.407 · 1.407±0.06 g/cm3(Predicted)
- storage temp.
- Hygroscopic, Refrigerator, under inert atmosphere
- solubility
- DMSO (Slightly), Ethyl Acetate (Slightly)
- form
- Solid
- pka
- 9.86 · 9.86±0.15(Predicted)
- color
- White to Off-White
- BRN
- 2052978 · 2052978
- Stability
- Hygroscopic
- CAS DataBase Reference
- 14868 · 14868-03-2(CAS DataBase Reference)
- FDA UNII
- 4668 GRX7T · U4668GRX7T
- EPA Substance Registry System
- 4 · Phenol, 4,4'-(dichloroethenylidene)bis- (14868-03-2)
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 315 · H315-H319-H335
- Precautionary statements
- 261 · P261-P264-P271-P280-P302+P352-P305+P351+P338
- Hazard Codes
- Xi
- Risk Statements
- 36 · 36/37/38
- Safety Statements
- 26 · 26-36
- WGK Germany
- 3 · 3
- TSCA
- TSCA listed
- HS Code
- 2907.29 · 2907.29.9000
Safety & regulation
GHS classification
GHS Classification
Warning
H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation];H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation];H335 (98%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposure; Respiratory tract irritation]
P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 50 reports by companies from 4 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.;Information may vary between notifications depending on impurities, additives, and other factors. The percentage value in parenthesis indicates the notified classification ratio from companies that provide hazard codes. Only hazard codes with percentage values above 10% are shown. For more detailed information, please visit ECHA C&L website.
Hazard information
Safety data
- wgk
- 3
- tsca
- TSCA listed
- hs_code
- 2907.29.9000
- risk_code
- 36/37/38
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- hazard_code
- Xi
- safety_code
- 26-36
- Hazard statements
- H315-H319-H335
- Precautionary statements
- P261-P264-P271-P280-P302+P352-P305+P351+P338
Chemistry & industry
Uses & manufacturing
Applications
UsesBisphenol C is a congener of Bisphenol A; a well known endocrine-disrupting chemical with estrogenic activity.
Upstream & downstream products
Upstream raw materials
Downstream products
Suppliers64 total
Additional notes
DefinitionChEBI: 1,1-Dichloro-2,2-bis(4-hydroxyphenyl)ethylene is a diarylmethane.
Related reactions
Compound notes
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