(3-Fluoro-4-methoxyphenyl)acetic acid
Properties
- Molecular formula
- C9H9FO3
- Molar mass
- 184.17 g/mol
- Exact mass
- 184.0536 Da
- Melting point
- 116 °C
- logP
- 1.46Crippen estimate
- Polar surface area
- 46.5 Ų
- H-bond donors / acceptors
- 1 / 2
- Rotatable bonds
- 3
Hazards
Danger
- H315 Causes skin irritation50% of notifiers
- H318 Causes serious eye damage50% of notifiers
- H319 Causes serious eye irritation50% of notifiers
- H335 May cause respiratory irritation50% of notifiers
Aggregated from 4 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.
Precautionary statements
P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P305+P354+P338, P317, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, P501
Identifiers
CAS number
452-14-2SMILES
COc1ccc(CC(=O)O)cc1FInChIKey
VURNBRZIFABCRU-UHFFFAOYSA-NInChI
InChI=1S/C9H9FO3/c1-13-8-3-2-6(4-7(8)10)5-9(11)12/h2-4H,5H2,1H3,(H,11,12)Weigh it out
Type any one amount. The others follow from the molar mass.
Names and synonyms
4 names
- Benzeneacetic acid, 3-fluoro-4-methoxy-
- Acetic acid, (3-fluoro-4-methoxyphenyl)-
- 3-Fluoro-4-methoxybenzeneacetic acid
- 2-(3-Fluoro-4-methoxyphenyl)acetic acid
Work with (3-Fluoro-4-methoxyphenyl)acetic acid
Similar compounds
(3,4-Dimethoxyphenyl)acetic acid93-40-375 % similar
3-Hydroxy-4-methoxybenzeneacetic acid1131-94-869 % similar
4-Methoxy-3-methylphenylacetic acid4513-73-969 % similar
(3,4-Difluorophenyl)acetic acid658-93-569 % similar
3-Bromo-4-methoxyphenylacetic acid774-81-268 % similar
Homovanillic acid306-08-165 % similar
4-Ethoxy-3-methoxybenzeneacetic acid120-13-864 % similar
3-Fluoro-4-methoxy-γ-oxobenzenebutanoic acid347-63-761 % similar
Tanimoto similarity of circular fingerprints over the whole catalogue.