2-Fluoro-3-methylphenol

C₇H₇FOCAS 77772-72-6126.13 g/mol

Open in Covalent MOL file

Aryl halide Phenol

Properties

Molecular formula: C₇H₇FO
Molar mass: 126.13 g/mol
Exact mass: 126.0481 Da
logP: 1.84Crippen estimate
Polar surface area: 20.2 Å²
H-bond donors / acceptors: 1 / 1
Rotatable bonds: 0

Hazards

No GHS classification is on file for this compound. That is not evidence that it is harmless. Search the SDS library

Identifiers

CAS number

77772-72-6

SMILES

CC1=C(C(=CC=C1)O)F

InChIKey

QTCQBPOWSWCJLQ-UHFFFAOYSA-N

InChI

InChI=1S/C7H7FO/c1-5-3-2-4-6(9)7(5)8/h2-4,9H,1H3

Weigh it out

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

Work with 2-Fluoro-3-methylphenol

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-Fluoro-1,3-dimethylbenzene443-88-965 % similar O-Cresol95-48-756 % similar Dimethylphenol1300-71-656 % similar 1,2-Difluoro-3-methylbenzene3828-49-756 % similar 3-Methylcatechol488-17-556 % similar 2,3-Dimethylphenol526-75-056 % similar 2,3-Difluorophenol6418-38-856 % similar 3-Bromo-2-fluorophenol156682-53-054 % similar

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

Same formula

3-Fluoro-5-methylphenol216976-31-7 2-Fluoroanisole321-28-8 3-Fluoro-2-methylphenol443-87-8 2-Fluorobenzyl alcohol446-51-5 4-Fluoro-3-methylphenol452-70-0 4-Fluoro-2-methylphenol452-72-2 3-Fluoro-4-methylphenol452-78-8 2-Fluoro-4-methylphenol452-81-3

Elsewhere

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