chempirical

3-Fluoro-4-methylbenzyl alcohol

C8H9FOCAS 192702-79-7140.16 g/mol

Open in Covalent MOL file
OHF
AlcoholAryl halide

Properties

Molecular formula
C8H9FO
Molar mass
140.16 g/mol
Exact mass
140.0637 Da
logP
1.63Crippen estimate
Polar surface area
20.2 Ų
H-bond donors / acceptors
1 / 1
Rotatable bonds
1

Identifiers

CAS number
192702-79-7
SMILES
CC1=C(C=C(C=C1)CO)F
InChIKey
UUVJAGTYIVYFOS-UHFFFAOYSA-N
InChI
InChI=1S/C8H9FO/c1-6-2-3-7(5-10)4-8(6)9/h2-4,10H,5H2,1H3

Weigh it out

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Names and synonyms

1 names
  • (3-Fluoro-4-methylphenyl)methanol

Work with 3-Fluoro-4-methylbenzyl 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

3,4-Dimethylbenzyl alcohol6966-10-564 % similar 3,4-Difluorobenzenemethanol85118-05-464 % similar 3-Fluoro-4-methylbenzyl bromide145075-44-161 % similar 3-Fluoro-4-methylbenzenemethanamine261951-67-161 % similar (4-Bromo-3-fluorophenyl)methanol222978-01-056 % similar 3-Fluoro-4-methylphenol452-78-852 % similar (4-Bromo-3-methylphenyl)methanol149104-89-252 % similar 3-Chloro-4-fluorobenzyl alcohol161446-90-852 % similar

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

Same formula

(R)-1-(4-Fluorophenyl)ethanol101219-68-5 (-)-1-(4-Fluorophenyl)ethanol101219-73-2 (S)-1-(2-Fluorophenyl)ethanol171032-87-4 1-Fluoro-4-methoxy-2-methylbenzene2338-54-7 4-Fluoro-1-methoxy-2-methylbenzene399-54-2 2-Fluoro-4-methylanisole399-55-3 3-Fluoro-α-methylbenzenemethanol402-63-1 1-(4-Fluorophenyl)ethanol403-41-8

Elsewhere

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