4-Bromo-2-chloro-6-fluorophenol

C₆H₃BrClFOCAS 161045-79-0225.44 g/mol

Open in Covalent MOL file

Aryl halide Phenol

Properties

Molecular formula: C₆H₃BrClFO
Molar mass: 225.44 g/mol
Exact mass: 223.9040 Da
logP: 2.95Crippen estimate
Polar surface area: 20.2 Å²
H-bond donors / acceptors: 1 / 1
Rotatable bonds: 0

Identifiers

CAS number

161045-79-0

SMILES

Oc1c(F)cc(Br)cc1Cl

InChIKey

QEYONPKSDTUPAX-UHFFFAOYSA-N

InChI

InChI=1S/C6H3BrClFO/c7-3-1-4(8)6(10)5(9)2-3/h1-2,10H

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Names and synonyms

1 names

Phenol, 4-bromo-2-chloro-6-fluoro-

Work with 4-Bromo-2-chloro-6-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

4-Bromo-2,6-difluorophenol104197-13-969 % similar 4-Bromo-2,6-dichlorophenol3217-15-069 % similar 2,4-Dibromo-6-fluorophenol576-86-360 % similar 4-Bromo-6-chloro-2-cresol7530-27-056 % similar 2-Chloro-6-fluorophenol2040-90-653 % similar 5-Bromo-1,3-dichloro-2-fluorobenzene17318-08-052 % similar 4-Bromo-1-chloro-2-fluorobenzene60811-18-952 % similar 4-Bromo-2-chloro-1-fluorobenzene60811-21-452 % similar

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

Same formula

2-Bromo-4-chloro-6-fluorophenol886499-88-3

Elsewhere

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