5-Fluoro-2-methoxyphenol

C₇H₇FO₂CAS 72955-97-6142.13 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
logP: 1.54Crippen estimate
Polar surface area: 29.5 Å²
H-bond donors / acceptors: 1 / 2
Rotatable bonds: 1

Hazards

Danger

H302 Harmful if swallowed50% of notifiers
H312 Harmful in contact with skin25% of notifiers
H314 Causes severe skin burns and eye damage75% of notifiers
H332 Harmful if inhaled25% of notifiers

Aggregated from 4 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.

Precautionary statements

P260, P261, P264, P270, P271, P280, P301+P317, P301+P330+P331, P302+P352, P302+P361+P354, P304+P340, P305+P354+P338, P316, P317, P321, P330, P362+P364, P363, P405, P501

Identifiers

CAS number

72955-97-6

SMILES

COC1=C(C=C(C=C1)F)O

InChIKey

PPJKLEQAFZWIQY-UHFFFAOYSA-N

InChI

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

Weigh it out

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

Work with 5-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 2,5-Dimethoxyphenol18113-18-360 % similar 2,4-Difluoroanisole452-10-860 % similar 2-Methoxy-5-methylphenol1195-09-158 % similar 5-Fluoro-2-methoxyaniline1978-39-858 % similar 4-Fluoro-1-methoxy-2-methylbenzene399-54-258 % similar 5-Amino-2-methoxyphenol1687-53-256 % similar 2-Chloro-4-fluoro-1-methoxybenzene2267-25-656 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Same formula

2-Fluoro-4-methoxyphenol167683-93-4 4-Fluoro-2-methoxyphenol450-93-1 3-Fluoro-4-methoxyphenol452-11-9 2-Fluoro-6-methoxyphenol73943-41-6

Elsewhere

PubChem CAS Common Chemistry NIST WebBook