Basic information
- Standard SMILES
CC(O)(c1ccc(Cl)cc1)C1CC1- InChIKey
OSFCGPVNQAPOHW-UHFFFAOYSA-N- Molecular formula
- C11H13ClO
- Average molar mass
- 196.67 g/mol
- Monoisotopic mass
- 196.06549272
Names & identifiers
- Preferred name
- 4-Chloro-alpha-cyclopropyl-alpha-methylbenzenemethanol
- IUPAC
- 1-(4-chlorophenyl)-1-cyclopropylethanol
- English name
- 4-chloro-alpha-cyclopropyl-alpha-methylbenzyl alcohol
- Molecular formula
- C11H13ClO
- Molecular weight
- 196.67
Names & synonyms
62586-85-04-Chloro-alpha-cyclopropyl-alpha-methylbenzyl alcoholRefChem:10705134-Chloro-alpha-cyclopropyl-alpha-methylbenzenemethanol263-613-41-(4-chlorophenyl)-1-cyclopropylethanol1-(4-Chlorophenyl)-1-cyclopropylethan-1-ol1-(4-Chlorophenyl)-1-cyclopropyl ethanol7054-64-0BRN 2253827dl-4-Chlorophenyl cyclopropyl methyl carbinolEthanol, 1-(p-chlorophenyl)-1-cyclopropyl-
Show more names
α-Cyclopropyl-α-methyl-4-chlorobenzyl alcohol4-Chloro-α-cyclopropyl-α-methylbenzenemethanol4-Chloro-α-cyclopropyl-α-methylbenzenemethanolBenzenemethanol, 4-chloro-α-cyclopropyl-α-methyl-p-Chloro-ALPHA-cyclopropyl-ALPHA-methylbenzyl alcohol
EINECS 263-613-4MFCD00019245dl-p-Chloro-alpha-cyclopropyl-alpha-methylbenzyl alcoholBENZYL ALCOHOL, p-CHLORO-alpha-CYCLOPROPYL-alpha-METHYL-, dl-SCHEMBL1350229DTXSID70978161OSFCGPVNQAPOHW-UHFFFAOYSA-N1-Cyclopropyl-1-(4-chlorophenyl)ethanol
Database identifiers
- CAS
62586-85-0、7054-64-0- PubChem CID
- 23463
- DTXSID
DTXSID70978161- EC Number
- 263-613-4
- Nikkaji
- J307.077H
Properties
Computed structural properties
- XLogP
- 3.6
- Topological polar surface area
- 20.2 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 2
- Heavy atoms
- 13
- Formal charge
- 0
- Complexity
- 183
Physicochemical properties
- Boiling point
- 102 · 102-104 °C(Press: 1 Torr)
- Density
- 1.1498 g/cm3 · 1.1498 g/cm3
- pka
- 14.16 · 14.16±0.29(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
14 records
Linked notes
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