Basic information
- CAS
6279-35-2- Standard SMILES
OC(Cc1ccc(Cl)cc1)c1ccccc1- InChIKey
WYNMJDIRSBDUDO-UHFFFAOYSA-N- Molecular formula
- C14H13ClO
- Average molar mass
- 232.7 g/mol
- Monoisotopic mass
- 232.0654927
Names & identifiers
- Preferred name
- 2-(4-Chlorophenyl)-1-phenylethanol
- IUPAC
- 2-(4-chlorophenyl)-1-phenylethanol
- English name
- 1-Phenyl-2-(4-chlorophenyl)ethanol
- Molecular formula
- C14H13ClO
- Molecular weight
- 232.71
Names & synonyms
2-(4-Chlorophenyl)-1-phenylethanol6279-35-2DTXSID50279108RefChem:252168DTXCID00230264Phenethyl alcohol, p-chloro-.alpha.-phenyl-NSC112892-(4-chlorophenyl)-1-phenylethan-1-olSCHEMBL1129900SCHEMBL25343509SCHEMBL28045559SCHEMBL28271798
Show more names
Benzeneethanol, 4-chloro-α-phenyl-p-Chloro-α-phenylphenethyl alcohol1-Phenyl-2-(4-chlorophenyl)ethanol
WYNMJDIRSBDUDO-UHFFFAOYSA-NNSC-11289AKOS0091162592-(4-Chlorophenyl)-1-phenylethanol #
Database identifiers
- CAS
6279-35-2- PubChem CID
- 223554
- DTXSID
DTXSID50279108- Nikkaji
- J104.361G
Properties
Computed structural properties
- XLogP
- 3.7
- Topological polar surface area
- 20.2 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 3
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 193
Physicochemical properties
- Melting point
- 55 · 55.0-56.5 °C
- Boiling point
- 338 · 338.0±27.0 °C(Predicted)
- Density
- 1.204 · 1.204±0.06 g/cm3(Predicted)
- pka
- 13.97 · 13.97±0.20(Predicted)
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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