2-Chloro-3-(trifluoromethyl)benzyl alcohol

C₈H₆ClF₃OCAS 261763-20-6210.58 g/mol

Open in Covalent MOL file

Alcohol Alkyl halide Aryl halide

Properties

Molecular formula: C₈H₆ClF₃O
Molar mass: 210.58 g/mol
Exact mass: 210.0059 Da
logP: 2.85Crippen estimate
Polar surface area: 20.2 Å²
H-bond donors / acceptors: 1 / 1
Rotatable bonds: 1

Identifiers

CAS number

261763-20-6

SMILES

C1=CC(=C(C(=C1)C(F)(F)F)Cl)CO

InChIKey

MQUXXVLMXCHGDZ-UHFFFAOYSA-N

InChI

InChI=1S/C8H6ClF3O/c9-7-5(4-13)2-1-3-6(7)8(10,11)12/h1-3,13H,4H2

Weigh it out

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

Work with 2-Chloro-3-(trifluoromethyl)benzyl 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-(Trifluoromethyl)benzenemethanol346-06-567 % similar 2-Fluoro-3-(trifluoromethyl)benzyl alcohol207981-45-164 % similar 2-Chloro-3-(trifluoromethyl)benzylamine39226-96-564 % similar 2-Chloro-3-(trifluoromethyl)phenol138377-34-155 % similar 1,2-Dichloro-3-(trifluoromethyl)benzene54773-19-253 % similar 1-Bromo-2-chloro-3-(trifluoromethyl)benzene56131-47-652 % similar 2-Fluoro-6-(trifluoromethyl)benzyl alcohol152211-15-950 % similar 2-(Trifluoromethyl)benzeneethanol94022-96-549 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue. All similar compounds

Same formula

[5-Chloro-2-(trifluoromethyl)phenyl]methanol261763-21-7 4-Chloro-3-(trifluoromethyl)anisole400-73-7 2-Chloro-4-(trifluoromethyl)benzenemethanol56456-51-0

Elsewhere

PubChem CAS Common Chemistry NIST WebBook