chempirical

5-Fluoro-2-(trifluoromethyl)benzenemethanol

C8H6F4OCAS 238742-82-0194.13 g/mol

Open in Covalent MOL file
OHFFFF
AlcoholAlkyl halideAryl halide

Properties

Molecular formula
C8H6F4O
Molar mass
194.13 g/mol
Exact mass
194.0355 Da
logP
2.34Crippen estimate
Polar surface area
20.2 Ų
H-bond donors / acceptors
1 / 1
Rotatable bonds
1

Identifiers

CAS number
238742-82-0
SMILES
OCc1cc(F)ccc1C(F)(F)F
InChIKey
AGVUJWYLCSOJDS-UHFFFAOYSA-N
InChI
InChI=1S/C8H6F4O/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

3 names
  • Benzenemethanol, 5-fluoro-2-(trifluoromethyl)-
  • 2-Trifluoromethyl-5-fluorobenzyl alcohol
  • [5-Fluoro-2-(trifluoromethyl)phenyl]methanol

Work with 5-Fluoro-2-(trifluoromethyl)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

5-Fluoro-2-(trifluoromethyl)benzenemethanamine231291-14-864 % similar 2-(Trifluoromethyl)benzenemethanol346-06-556 % similar 2,5-Difluorobenzenemethanol75853-20-256 % similar 2-Bromo-5-fluorobenzenemethanol202865-66-553 % similar 2-Chloro-5-fluorobenzenemethanol261762-59-853 % similar 2,4-Difluorobenzenemethanol56456-47-452 % similar 2-Bromo-4-fluoro-1-(trifluoromethyl)benzene351003-21-950 % similar 4-Fluoro-2-(trifluoromethyl)benzeneacetonitrile80141-94-250 % similar

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

Same formula

4-Fluoro-3-(trifluoromethyl)anisole127271-65-2 (1,1,2,2-Tetrafluoroethoxy)benzene350-57-2 4-Methyl-2,3,5,6-tetrafluorobenzyl alcohol79538-03-7

Elsewhere

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