2-Bromo-5-chlorobenzenamine

C₆H₅BrClNCAS 823-57-4206.47 g/mol

Open in Covalent MOL file

Aryl halide Primary amine

Properties

Molecular formula: C₆H₅BrClN
Molar mass: 206.47 g/mol
Exact mass: 204.9294 Da
Melting point: 59 °C
Boiling point: 127–128 °C (at 7 Torr)
logP: 2.68Crippen estimate
Polar surface area: 26.0 Å²
H-bond donors / acceptors: 1 / 1
Rotatable bonds: 0

Identifiers

CAS number

823-57-4

SMILES

Nc1cc(Cl)ccc1Br

InChIKey

NLEZSQHAFMZAGU-UHFFFAOYSA-N

InChI

InChI=1S/C6H5BrClN/c7-5-2-1-4(8)3-6(5)9/h1-3H,9H2

Weigh it out

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

Names and synonyms

4 names

Benzenamine, 2-bromo-5-chloro-
Aniline, 2-bromo-5-chloro-
2-Bromo-5-chloroaniline
2-Bromo-5-chloro-phenylamine

Work with 2-Bromo-5-chlorobenzenamine

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-Chloro-1,2-phenylenediamine95-83-060 % similar 1-Bromo-2,4-dichlorobenzene1193-72-256 % similar 2,5-Dibromoaniline3638-73-156 % similar 2,5-Dichloroaniline95-82-956 % similar 2-Bromo-5-fluorobenzenamine1003-99-252 % similar 3-Amino-4-bromophenol100367-37-152 % similar 2-Amino-4-chlorothiophenol1004-00-852 % similar 2-Bromo-5-chlorophenol13659-23-952 % similar

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

Same formula

3-Bromo-6-chloro-2-methylpyridine132606-40-7 3-Bromo-2-chloro-5-methylpyridine17282-03-0 4-Bromo-3-chloroaniline21402-26-6 4-Bromo-2-chloroaniline38762-41-3 3-Bromo-2-chloro-4-methylpyridine55404-31-4 2-Bromo-4-chloroaniline873-38-1

Elsewhere

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