Basic information
- CAS
56667-10-8- Standard SMILES
OC1(c2ccccc2)C=CCC1- InChIKey
HWHIPJCQHCODCL-UHFFFAOYSA-N- Molecular formula
- C11H12O
- Average molar mass
- 160.21 g/mol
- Monoisotopic mass
- 160.088815
Names & identifiers
- Preferred name
- 1-Phenyl-2-cyclopenten-1-ol
- IUPAC
- 1-phenylcyclopent-2-en-1-ol
- English name
- 1-Phenyl-2-cyclopenten-1-ol
- Molecular formula
- C11H12O
- Molecular weight
- 160.21
Names & synonyms
1-PHENYL-2-CYCLOPENTEN-1-OL56667-10-8RefChem:10563121-phenylcyclopent-2-en-1-ol2-Cyclopenten-1-ol, 1-phenyl-SCHEMBL9242395DTXSID40972111HWHIPJCQHCODCL-UHFFFAOYSA-NDB-312310(RS)-1-phenylcyclopent-2-en-1-ol 12
Database identifiers
- CAS
56667-10-8- PubChem CID
- 41963
- DTXSID
DTXSID40972111- Nikkaji
- J113.795F
Properties
Computed structural properties
- XLogP
- 2.1
- Topological polar surface area
- 20.2 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 1
- Heavy atoms
- 12
- Formal charge
- 0
- Complexity
- 179
Physicochemical properties
- Melting point
- 109 · 109-111 °C(Solv: ethyl ether (60-29-7); ligroine (8032-32-4))
- Boiling point
- 280.3 · 280.3±29.0 °C(Predicted)
- Density
- 1.131 · 1.131±0.06 g/cm3(Predicted)
- pka
- 13.85 · 13.85±0.20(Predicted)
Chemistry & industry
Suppliers1 total
珠海奥博凯生物医药技术有限公司400-0628126 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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