5-Fluoro-2-methoxybenzeneacetic acid

C₉H₉FO₃CAS 383134-85-8184.17 g/mol

Open in Covalent MOL file

Aryl halide Carboxylic acid Ether

Properties

Molecular formula: C₉H₉FO₃
Molar mass: 184.17 g/mol
Exact mass: 184.0536 Da
logP: 1.46Crippen estimate
Polar surface area: 46.5 Å²
H-bond donors / acceptors: 1 / 2
Rotatable bonds: 3

Identifiers

CAS number

383134-85-8

SMILES

COc1ccc(F)cc1CC(=O)O

InChIKey

WGZCWKASVDIAOH-UHFFFAOYSA-N

InChI

InChI=1S/C9H9FO3/c1-13-8-3-2-7(10)4-6(8)5-9(11)12/h2-4H,5H2,1H3,(H,11,12)

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

Names and synonyms

5 names

Benzeneacetic acid, 5-fluoro-2-methoxy-
NSC 190367
NSC 190372
2-(5-Fluoro-2-methoxyphenyl)acetic acid
(5-Fluoro-2-methoxy-phenyl)-acetic acid

Work with 5-Fluoro-2-methoxybenzeneacetic 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

2,5-Dimethoxyphenylacetic acid1758-25-469 % similar 2,5-Difluorobenzeneacetic acid85068-27-562 % similar 2-Methoxyphenylacetic acid93-25-462 % similar 2,3,4-Trimethoxybenzeneacetic acid22480-91-759 % similar 2,4-Difluorophenylacetic acid81228-09-357 % similar (3,4-Dimethoxyphenyl)acetic acid93-40-356 % similar 2-Chloro-4-fluorobenzeneacetic acid177985-32-955 % similar 2-Bromo-4-fluorobenzeneacetic acid61150-59-255 % similar

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

Same formula

3-(4-Fluorophenoxy)propanoic acid1579-78-8 Methyl 4-fluoro-2-methoxybenzoate204707-42-6 (3-Fluoro-4-methoxyphenyl)acetic acid452-14-2

Elsewhere

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