5-Bromo-2,3-difluorophenol

C₆H₃BrF₂OCAS 186590-26-1208.99 g/mol

Open in Covalent MOL file

Aryl halide Phenol

Properties

Molecular formula: C₆H₃BrF₂O
Molar mass: 208.99 g/mol
Exact mass: 207.9335 Da
logP: 2.43Crippen estimate
Polar surface area: 20.2 Å²
H-bond donors / acceptors: 1 / 1
Rotatable bonds: 0

Identifiers

CAS number

186590-26-1

SMILES

Oc1cc(Br)cc(F)c1F

InChIKey

QAHCQGXGAYRHHW-UHFFFAOYSA-N

InChI

InChI=1S/C6H3BrF2O/c7-3-1-4(8)6(9)5(10)2-3/h1-2,10H

Weigh it out

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

Names and synonyms

2 names

Phenol, 5-bromo-2,3-difluoro-
2,3-Difluoro-5-bromophenol

Work with 5-Bromo-2,3-difluorophenol

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

5-Bromo-1,2,3-trifluorobenzene138526-69-967 % similar 5-Bromo-2-fluorophenol112204-58-755 % similar 4-Bromo-2-fluorophenol2105-94-455 % similar 5-Bromo-1,2-difluoro-3-methoxybenzene261762-35-048 % similar 2,4-Dibromo-6-fluorophenol576-86-348 % similar 1,4-Dibromo-3,5-difluorobenzene128259-71-248 % similar 1,2,5-Tribromo-3-fluorobenzene2839-37-447 % similar 4-Bromo-2-chloro-6-fluorophenol161045-79-045 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue. All similar compounds

Same formula

4-Bromo-2,6-difluorophenol104197-13-9 4-Bromo-3,5-difluorophenol130191-91-2 4-Bromo-2,3-difluorophenol144292-32-0 2-Bromo-4,5-difluorophenol166281-37-4 4-Bromo-2,5-difluorophenol486424-36-6 2-Bromo-4,6-difluorophenol98130-56-4

Elsewhere

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