[5-Chloro-2-(trifluoromethyl)phenyl]methanol

C₈H₆ClF₃OCAS 261763-21-7210.58 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

261763-21-7

SMILES

C1=CC(=C(C=C1Cl)CO)C(F)(F)F

InChIKey

LUMJBVGPYBBQAP-UHFFFAOYSA-N

InChI

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

Weigh it out

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

Names and synonyms

1 names

5-Chloro-2-(trifluoromethyl)benzyl alcohol

Work with [5-Chloro-2-(trifluoromethyl)phenyl]methanol

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-(Bromomethyl)-4-chloro-1-(trifluoromethyl)benzene261763-24-065 % similar 2,5-Bis(trifluoromethyl)benzyl alcohol302911-97-364 % similar 5-Fluoro-2-(trifluoromethyl)benzenemethanol238742-82-062 % similar 2,4-Dichlorobenzotrifluoride320-60-555 % similar 2,5-Dichlorobenzenemethanol34145-05-655 % similar 2-(Trifluoromethyl)benzenemethanol346-06-555 % similar 5-Chloro-2-hydroxybenzenemethanol5330-38-153 % similar 2-Amino-5-chlorobenzyl alcohol37585-25-451 % similar

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

Same formula

2-Chloro-3-(trifluoromethyl)benzyl alcohol261763-20-6 4-Chloro-3-(trifluoromethyl)anisole400-73-7 2-Chloro-4-(trifluoromethyl)benzenemethanol56456-51-0

Elsewhere

PubChem CAS Common Chemistry NIST WebBook