2-Chloro-6-fluoro-3-methylbenzyl alcohol

C8H8ClFOCAS 261762-83-8174.60 g/mol

Open in Covalent MOL file
FOHCl
AlcoholAryl halide

Properties

Molecular formula
C8H8ClFO
Molar mass
174.60 g/mol
Exact mass
174.0248 Da
logP
2.28Crippen estimate
Polar surface area
20.2 Ų
H-bond donors / acceptors
1 / 1
Rotatable bonds
1

Hazards

Warning
Irritant (GHS07)

Aggregated from 5 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.

Precautionary statements

P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, P501

Identifiers

CAS number
261762-83-8
SMILES
CC1=C(C(=C(C=C1)F)CO)Cl
InChIKey
PQHOAHOMVOQUAU-UHFFFAOYSA-N
InChI
InChI=1S/C8H8ClFO/c1-5-2-3-7(10)6(4-11)8(5)9/h2-3,11H,4H2,1H3

Weigh it out

Type any one amount. The others follow from the molar mass.

Work with 2-Chloro-6-fluoro-3-methylbenzyl alcohol

Predict the NMR spectrum1H and 13C shifts with multiplicities Make a solutionWhat to weigh for any molarity and volume Check drug-likenessLipinski, Veber and lead-likeness Isotope patternExact mass and the mass spectrum pattern

Similar compounds

2-Chloro-3,6-difluorobenzenemethanol261762-44-170 % similar 2-Chloro-6-fluoro-3-methylphenylacetic acid261762-92-959 % similar 2,6-Difluorobenzenemethanol19064-18-752 % similar 2-Chloro-6-fluorobenzenemethanol56456-50-949 % similar 2,3,6-Trifluorobenzyl alcohol114152-19-148 % similar 2-Chloro-6-fluoro-3-methylbenzoic acid32890-89-448 % similar 2-Chloro-6-fluoro-3-methylbenzaldehyde104451-99-247 % similar 3-Fluoro-4-methylbenzyl alcohol192702-79-747 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Same formula

2-(2-Chloro-6-fluorophenyl)ethanol214262-86-9 6-Chloro-2-fluoro-3-methylbenzyl alcohol261762-84-9 3-Fluoro-4-methoxybenzyl chloride351-52-0

Elsewhere

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