Basic information
- CAS
46765-25-7- Standard SMILES
CC(C)(c1ccc(O)cc1)c1cccc(O)c1- InChIKey
ZFXDUWYVZMVVQT-UHFFFAOYSA-N- Molecular formula
- C15H16O2
- Average molar mass
- 228.29 g/mol
- Monoisotopic mass
- 228.11502975
Names & identifiers
- Preferred name
- 3-[1-(4-Hydroxyphenyl)-isopropyl]phenol
- IUPAC
- 3-[2-(4-hydroxyphenyl)propan-2-yl]phenol
- English name
- 3,4'-(1-Methylethylidene)bisphenol
- Molecular formula
- C15H16O2
- Molecular weight
- 228.29
Names & synonyms
46765-25-73-[1-(4-hydroxyphenyl)-isopropyl]phenol3-[2-(4-hydroxyphenyl)propan-2-yl]phenolSBB0571833-(2-(4-Hydroxyphenyl)propan-2-yl)phenol3-[1-(4-Hydroxyphenyl)-1-methylethyl]phenolSCHEMBL124881SCHEMBL29368890DTXSID10350861KUC105809NKSC-7-285AKOS024307450
Show more names
3,4'-Isopropylidenediphenol3,4'-Isopropylidenebisphenol3,4'-(1-Methylethylidene)bisphenol3,4'-(1-Methyl-1,1-ethanediyl)bisphenolPhenol, 3-[1-(4-hydroxyphenyl)-1-methylethyl]-
3,4'-ISOPROPYLIDENEDIPHENOL - 1GMST503197232-(3-hydroxyphenyl)-2-(4-hydroxyphenyl)propane2-(4-hydroxyphenyl)-2-(3-hydroxyphenyl) propane
Database identifiers
- CAS
46765-25-7- PubChem CID
- 688289
- DTXSID
DTXSID10350861- Nikkaji
- J106.035J
Properties
Computed structural properties
- XLogP
- 4
- Topological polar surface area
- 40.5 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 2
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 241
Physicochemical properties
- Melting point
- 121 °C · 121 °C
- Boiling point
- 398.7 · 398.7±22.0 °C(Predicted)
- Density
- 1.143 · 1.143±0.06 g/cm3(Predicted)
- pka
- 10.01 · 10.01±0.10(Predicted)
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 335 · H335-H319-H315
- Precautionary statements
- 264 · P264-P280-P302+P352-P321-P332+P313-P362-P264-P280-P305+P351+P338-P337+P313P
- Hazard Codes
- Xi
- Risk Statements
- 36 · 36/37/38
- Safety Statements
- 26 · 26-36
Safety & regulation
Safety data
- risk_code
- 36/37/38
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- hazard_code
- Xi
- safety_code
- 26-36
- Hazard statements
- H335-H319-H315
- Precautionary statements
- P264-P280-P302+P352-P321-P332+P313-P362-P264-P280-P305+P351+P338-P337+P313P
Chemistry & industry
Suppliers2 total
西格玛奥德里奇（上海）贸易有限公司21-20338288 · [email protected]
SIGMAALDRICH—
Related reactions
1 records
Compound notes
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