2-Fluoro-4-hydroxybenzoic acid

C₇H₅FO₃CAS 65145-13-3156.11 g/mol

Open in Covalent MOL file

Aryl halide Carboxylic acid Phenol

Properties

Molecular formula: C₇H₅FO₃
Molar mass: 156.11 g/mol
Exact mass: 156.0223 Da
Melting point: 200–202 °C
logP: 1.23Crippen estimate
Polar surface area: 57.5 Å²
H-bond donors / acceptors: 2 / 2
Rotatable bonds: 1

Identifiers

CAS number

65145-13-3

SMILES

O=C(O)c1ccc(O)cc1F

InChIKey

NXWTWYULZRDBSA-UHFFFAOYSA-N

InChI

InChI=1S/C7H5FO3/c8-6-3-4(9)1-2-5(6)7(10)11/h1-3,9H,(H,10,11)

Weigh it out

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

Names and synonyms

2 names

Benzoic acid, 2-fluoro-4-hydroxy-
4-Hydroxy-2-fluorobenzoic acid

Work with 2-Fluoro-4-hydroxybenzoic acid

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

4-Bromo-2-fluorobenzoic acid112704-79-767 % similar 4-Hydroxyphthalic acid610-35-567 % similar 2,4-Difluorobenzoic acid1583-58-066 % similar 2,4-Dihydroxybenzoic acid89-86-163 % similar 2-Fluoro-4-iodobenzoic acid124700-40-962 % similar 4-Chloro-2-fluorobenzoic acid446-30-062 % similar 4-Acetyl-3-fluorophenol98619-07-962 % similar 4-Cyano-2-fluorobenzoic acid164149-28-461 % similar

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

Same formula

5-Fluorosalicylic acid345-16-4 4-Fluoro-2-hydroxybenzoic acid345-29-9 3-Fluoro-4-hydroxybenzoic acid350-29-8 2-Fluoro-5-hydroxybenzoic acid51446-30-1

Elsewhere

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