4-Bromo-2-chlorophenol

C₆H₄BrClOCAS 3964-56-5207.45 g/mol

Open in Covalent MOL file

Aryl halide Phenol

Properties

Molecular formula: C₆H₄BrClO
Molar mass: 207.45 g/mol
Exact mass: 205.9134 Da
Melting point: 50.5 °C
Boiling point: 233.5 °C
logP: 2.81Crippen estimate
Polar surface area: 20.2 Å²
H-bond donors / acceptors: 1 / 1
Rotatable bonds: 0

Identifiers

CAS number

3964-56-5

SMILES

Oc1ccc(Br)cc1Cl

InChIKey

VIBJPUXLAKVICD-UHFFFAOYSA-N

InChI

InChI=1S/C6H4BrClO/c7-4-1-2-6(9)5(8)3-4/h1-3,9H

Weigh it out

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

Names and synonyms

2 names

Phenol, 4-bromo-2-chloro-
2-Chloro-4-bromophenol

Work with 4-Bromo-2-chlorophenol

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 Boiling point under vacuumAt any pressure, from its normal boiling point Isotope patternExact mass and the mass spectrum pattern

Similar compounds

Chlorohydroquinone615-67-864 % similar 4-Bromocatechol17345-77-663 % similar 4-Bromo-1,2-dichlorobenzene18282-59-263 % similar 2,4-Dichlorophenol120-83-258 % similar 2,4-Dibromophenol615-58-758 % similar 2-Chloro-4-methylphenol6640-27-356 % similar 4-Bromo-2,6-dichlorophenol3217-15-054 % similar 2-Chloro-4-fluorophenol1996-41-454 % similar

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

Same formula

4-Bromo-3-chlorophenol13631-21-5 2-Bromo-5-chlorophenol13659-23-9 3-Bromo-4-chlorophenol13659-24-0 5-Bromo-2-chlorophenol183802-98-4 3-Bromo-5-chlorophenol56962-04-0 2-Bromo-4-chlorophenol695-96-5

Elsewhere

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