2-(Trifluoromethyl)benzeneethanol

C₉H₉F₃OCAS 94022-96-5190.17 g/mol

Open in Covalent MOL file

Alcohol Alkyl halide

Properties

Molecular formula: C₉H₉F₃O
Molar mass: 190.17 g/mol
Exact mass: 190.0605 Da
logP: 2.24Crippen estimate
Polar surface area: 20.2 Å²
H-bond donors / acceptors: 1 / 1
Rotatable bonds: 2

Identifiers

CAS number

94022-96-5

SMILES

OCCc1ccccc1C(F)(F)F

InChIKey

DBKIEXOOUXQPGC-UHFFFAOYSA-N

InChI

InChI=1S/C9H9F3O/c10-9(11,12)8-4-2-1-3-7(8)5-6-13/h1-4,13H,5-6H2

Weigh it out

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

Names and synonyms

4 names

Benzeneethanol, 2-(trifluoromethyl)-
2-(2-Trifluoromethylphenyl)ethanol
2-(Trifluoromethyl)phenethyl alcohol
2-[2-(Trifluoromethyl)phenyl]ethan-1-ol

Work with 2-(Trifluoromethyl)benzeneethanol

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)benzenemethanol346-06-566 % similar 2-(Trifluoromethyl)benzeneethanamine774-18-561 % similar 2-(Trifluoromethyl)benzenepropanoic acid94022-99-856 % similar 2-(Trifluoromethyl)benzenemethanamine3048-01-955 % similar 2-Trifluoromethylbenzyl bromide395-44-855 % similar 2-(Trifluoromethyl)benzeneacetonitrile3038-47-953 % similar [2-(Trifluoromethyl)phenyl]acetic acid3038-48-050 % similar 1,2-Bis(trifluoromethyl)benzene433-95-450 % similar

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

Same formula

α-Methyl-4-(trifluoromethyl)benzenemethanol1737-26-4 1-(2-(Trifluoromethyl)phenyl)ethanol79756-81-3

Elsewhere

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