4-Fluoro-1,2-benzenediol

C6H5FO2CAS 367-32-8128.10 g/mol

Open in Covalent MOL file
HOFHO
Aryl halidePhenol

Properties

Molecular formula
C6H5FO2
Molar mass
128.10 g/mol
Exact mass
128.0274 Da
Melting point
90–91 °C
logP
1.24Crippen estimate
Polar surface area
40.5 Ų
H-bond donors / acceptors
2 / 2
Rotatable bonds
0

Hazards

Danger
Corrosive (GHS05)

Aggregated from 3 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.

Precautionary statements

P260, P264, P264+P265, P280, P301+P330+P331, P302+P361+P354, P304+P340, P305+P354+P338, P316, P317, P321, P363, P405, P501

Identifiers

CAS number
367-32-8
SMILES
Oc1ccc(F)cc1O
InChIKey
NFWGQJUHSAGJBE-UHFFFAOYSA-N
InChI
InChI=1S/C6H5FO2/c7-4-1-2-5(8)6(9)3-4/h1-3,8-9H

Weigh it out

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Names and synonyms

4 names
  • 1,2-Benzenediol, 4-fluoro-
  • Pyrocatechol, 4-fluoro-
  • 4-Fluoropyrocatechol
  • 4-Fluoro-2-hydroxyphenol

Work with 4-Fluoro-1,2-benzenediol

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-Difluorophenol2713-31-765 % similar 2,4-Difluorophenol367-27-165 % similar 2-Chloro-5-fluorophenol3827-49-463 % similar 2-Bromo-5-fluorophenol147460-41-160 % similar 2-Chloro-4-fluorophenol1996-41-460 % similar 2-Amino-4-fluorophenol399-97-360 % similar 4-Fluoro-2-methylphenol452-72-260 % similar 5-Fluoro-2-methylphenol452-85-760 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Same formula

4-Fluoro-1,3-dihydroxybenzene103068-41-3 3-Fluoro-1,2-benzenediol363-52-0

Elsewhere

PubChem CAS Common Chemistry NIST WebBook