2,3-Difluoro-4-methoxyphenol

C₇H₆F₂O₂CAS 261763-29-5160.12 g/mol

Open in Covalent MOL file

Aryl halide Ether Phenol

Properties

Molecular formula: C₇H₆F₂O₂
Molar mass: 160.12 g/mol
Exact mass: 160.0336 Da
logP: 1.68Crippen estimate
Polar surface area: 29.5 Å²
H-bond donors / acceptors: 1 / 2
Rotatable bonds: 1

Hazards

Danger

H302 Harmful if swallowed100% of notifiers
H312 Harmful in contact with skin20% of notifiers
H315 Causes skin irritation100% of notifiers
H318 Causes serious eye damage80% of notifiers
H319 Causes serious eye irritation20% of notifiers
H332 Harmful if inhaled20% of notifiers
H335 May cause respiratory irritation100% of notifiers

Aggregated from 5 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, P305+P354+P338, P317, P319, P321, P330, P332+P317, P337+P317, P362+P364, P403+P233, P405, P501

Identifiers

CAS number

261763-29-5

SMILES

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

InChIKey

CKKAZWYLHGNVDZ-UHFFFAOYSA-N

InChI

InChI=1S/C7H6F2O2/c1-11-5-3-2-4(10)6(8)7(5)9/h2-3,10H,1H3

Weigh it out

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

Work with 2,3-Difluoro-4-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

1-Hydroxy-4-ethoxy-2,3-difluorobenzene126163-56-259 % similar 2,3,4-Trifluoroanisole203245-16-359 % similar 2,3-Difluoro-4-methoxyphenylboronic acid170981-41-655 % similar 4-Fluoro-2-methoxyphenol450-93-153 % similar 5-Fluoro-2-methoxyphenol72955-97-653 % similar 4-Butoxy-2,3-difluorophenol136239-68-453 % similar 2-Methoxybenzene-1,4-diol824-46-452 % similar 4-Amino-2,3-difluorophenol163733-99-150 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Same formula

4-(Difluoromethoxy)phenol87789-47-7

Elsewhere

PubChem CAS Common Chemistry NIST WebBook