2-Bromo-4-fluorophenol

C6H4BrFOCAS 496-69-5191.00 g/mol

Open in Covalent MOL file
HOFBr
Aryl halidePhenol

Properties

Molecular formula
C6H4BrFO
Molar mass
191.00 g/mol
Exact mass
189.9430 Da
Melting point
43 °C
Boiling point
89 °C (at 1 Torr)
logP
2.29Crippen estimate
Polar surface area
20.2 Ų
H-bond donors / acceptors
1 / 1
Rotatable bonds
0

Hazards

Warning
Irritant (GHS07)

Aggregated from 52 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
496-69-5
SMILES
Oc1ccc(F)cc1Br
InChIKey
MEYRABVEYCFHHB-UHFFFAOYSA-N
InChI
InChI=1S/C6H4BrFO/c7-5-3-4(8)1-2-6(5)9/h1-3,9H

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Names and synonyms

1 names
  • Phenol, 2-bromo-4-fluoro-

Work with 2-Bromo-4-fluorophenol

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

1,2-Dibromo-4-fluorobenzene2369-37-160 % similar 4-Fluoro-1,2-benzenediol367-32-860 % similar 2,6-Dibromo-4-fluorophenol344-20-758 % similar 2-Chloro-4-fluorophenol1996-41-457 % similar 2,4-Difluorophenol367-27-156 % similar 1-Bromo-2,5-difluorobenzene399-94-056 % similar 2-Bromo-1,4-benzenediol583-69-756 % similar 2,4-Dibromophenol615-58-756 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Same formula

5-Bromo-2-fluorophenol112204-58-7 4-Bromo-3-fluorophenol121219-03-2 2-Bromo-5-fluorophenol147460-41-1 3-Bromo-2-fluorophenol156682-53-0 2-Bromo-6-fluorophenol2040-89-3 4-Bromo-2-fluorophenol2105-94-4 3-Bromo-4-fluorophenol27407-11-0 3-Bromo-5-fluorophenol433939-27-6

Elsewhere

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