4-Chloro-alpha-cyclopropyl-alpha-methylbenzenemethanol

HCID 23463CAS 62586-85-0

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

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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