4-Fluoro-2-methoxyphenol

C₇H₇FO₂CAS 450-93-1142.13 g/mol

Open in Covalent MOL file

Aryl halide Ether Phenol

Properties

Molecular formula: C₇H₇FO₂
Molar mass: 142.13 g/mol
Exact mass: 142.0430 Da
Boiling point: 94–95 °C (at 16 Torr)
logP: 1.54Crippen estimate
Polar surface area: 29.5 Å²
H-bond donors / acceptors: 1 / 2
Rotatable bonds: 1

Hazards

Warning

H302 Harmful if swallowed13% of notifiers
H315 Causes skin irritation97.8% of notifiers
H319 Causes serious eye irritation89.1% of notifiers
H335 May cause respiratory irritation97.8% of notifiers

Aggregated from 46 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.

Precautionary statements

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

Identifiers

CAS number

450-93-1

SMILES

COc1cc(F)ccc1O

InChIKey

OULGLTLTWBZBLO-UHFFFAOYSA-N

InChI

InChI=1S/C7H7FO2/c1-10-7-4-5(8)2-3-6(7)9/h2-4,9H,1H3

Weigh it out

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

Names and synonyms

2 names

Phenol, 4-fluoro-2-methoxy-
2-Methoxy-4-fluorophenol

Work with 4-Fluoro-2-methoxyphenol

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-Fluoro-1,2-dimethoxybenzene398-62-964 % similar 2,4-Difluoroanisole452-10-860 % similar 1,4-Difluoro-2-methoxybenzene75626-17-460 % similar 2-Methoxybenzene-1,4-diol824-46-460 % similar 4-Fluoro-2-methoxyaniline450-91-958 % similar Creosol93-51-658 % similar 4-Chloro-2-methoxyphenol16766-30-656 % similar 2-Bromo-5-fluoroanisole450-88-456 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Same formula

2-Fluoro-4-methoxyphenol167683-93-4 3-Fluoro-4-methoxyphenol452-11-9 5-Fluoro-2-methoxyphenol72955-97-6 2-Fluoro-6-methoxyphenol73943-41-6

Elsewhere

PubChem CAS Common Chemistry NIST WebBook