2-Fluoro-5-hydroxybenzoic acid

C₇H₅FO₃CAS 51446-30-1156.11 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
logP: 1.23Crippen estimate
Polar surface area: 57.5 Å²
H-bond donors / acceptors: 2 / 2
Rotatable bonds: 1

Hazards

Danger

H302 Harmful if swallowed81.2% of notifiers
H315 Causes skin irritation18.8% of notifiers
H318 Causes serious eye damage81.2% of notifiers
H319 Causes serious eye irritation18.8% of notifiers
H335 May cause respiratory irritation18.8% of notifiers
H411 Toxic to aquatic life with long lasting effects81.2% of notifiers

Aggregated from 48 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.

Precautionary statements

P261, P264, P264+P265, P270, P271, P273, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P305+P354+P338, P317, P319, P321, P330, P332+P317, P337+P317, P362+P364, P391, P403+P233, P405, P501

Identifiers

CAS number

51446-30-1

SMILES

O=C(O)c1cc(O)ccc1F

InChIKey

CZNFABVUVHWEJF-UHFFFAOYSA-N

InChI

InChI=1S/C7H5FO3/c8-6-2-1-4(9)3-5(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-5-hydroxy-
6-Fluoro-3-hydroxybenzoic acid

Work with 2-Fluoro-5-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

5-Bromo-2-fluorobenzoic acid146328-85-067 % similar 4-Hydroxyphthalic acid610-35-567 % similar 2,5-Difluorobenzoic acid2991-28-866 % similar Gentisic acid490-79-963 % similar 2-Fluoro-5-iodobenzoic acid124700-41-062 % similar 2-Fluoro-5-methylbenzoic acid321-12-062 % similar 5-Chloro-2-fluorobenzoic acid394-30-962 % similar 5-Amino-2-fluorobenzoic acid56741-33-462 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Same formula

3-Fluoro-2-hydroxybenzoic acid341-27-5 5-Fluorosalicylic acid345-16-4 4-Fluoro-2-hydroxybenzoic acid345-29-9 3-Fluoro-4-hydroxybenzoic acid350-29-8 4-Fluoro-3-hydroxybenzoic acid51446-31-2 2-Fluoro-4-hydroxybenzoic acid65145-13-3 2-Fluoro-6-hydroxybenzoic acid67531-86-6

Elsewhere

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