2-(Trifluoromethoxy)benzenemethanol

C8H7F3O2CAS 175278-07-6192.14 g/mol

Open in Covalent MOL file
OHOFFF
AlcoholAlkyl halideEther

Properties

Molecular formula
C8H7F3O2
Molar mass
192.14 g/mol
Exact mass
192.0398 Da
logP
2.08Crippen estimate
Polar surface area
29.5 Ų
H-bond donors / acceptors
1 / 2
Rotatable bonds
2

Hazards

Warning
Irritant (GHS07)

Aggregated from 3 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
175278-07-6
SMILES
OCc1ccccc1OC(F)(F)F
InChIKey
ICOVMLDFMWLRJO-UHFFFAOYSA-N
InChI
InChI=1S/C8H7F3O2/c9-8(10,11)13-7-4-2-1-3-6(7)5-12/h1-4,12H,5H2

Weigh it out

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

Names and synonyms

3 names
  • Benzenemethanol, 2-(trifluoromethoxy)-
  • 2-(Trifluoromethoxy)benzyl alcohol
  • [2-(Trifluoromethoxy)phenyl]methanol

Work with 2-(Trifluoromethoxy)benzenemethanol

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-(Trifluoromethoxy)phenyl)methanamine175205-64-863 % similar 2-(Trifluoromethoxy)benzyl bromide198649-68-263 % similar 2-Triflnoromethoxybenzyl cyanide137218-25-859 % similar 2-(Trifluoromethoxy)benzeneacetic acid220239-67-858 % similar 2-Trifluoromethoxyphenol32858-93-853 % similar 2-Methoxybenzyl alcohol612-16-853 % similar (2-(Difluoromethoxy)phenyl)methanol72768-94-653 % similar 1-Fluoro-2-(trifluoromethoxy)benzene2106-18-552 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Same formula

3-(Trifluoromethoxy)anisole142738-94-1 4-(Trifluoromethoxy)benzenemethanol1736-74-9 3-(Trifluoromethoxy)benzyl alcohol50823-90-0 1-Methoxy-4-(trifluoromethoxy)benzene710-18-9

Elsewhere

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