2,4-Dibromoaniline

C₆H₅Br₂NCAS 615-57-6250.92 g/mol

Open in Covalent MOL file

Aryl halide Primary amine

Properties

Molecular formula: C₆H₅Br₂N
Molar mass: 250.92 g/mol
Exact mass: 248.8789 Da
Density: 2.26 g/mL
Melting point: 79.5 °C
Boiling point: 156 °C
logP: 2.79Crippen estimate
Polar surface area: 26.0 Å²
H-bond donors / acceptors: 1 / 1
Rotatable bonds: 0

Hazards

Danger

H301 Toxic if swallowed89.4% of notifiers
H302 Harmful if swallowed10.6% of notifiers
H315 Causes skin irritation97.9% of notifiers
H319 Causes serious eye irritation97.9% of notifiers
H332 Harmful if inhaled10.6% of notifiers
H335 May cause respiratory irritation95.7% of notifiers

Aggregated from 47 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.

Precautionary statements

P261, P264, P264+P265, P270, P271, P280, P301+P316, P301+P317, P302+P352, P304+P340, P305+P351+P338, P317, P319, P321, P330, P332+P317, P337+P317, P362+P364, P403+P233, P405, P501

Identifiers

CAS number

615-57-6

SMILES

Nc1ccc(Br)cc1Br

InChIKey

DYSRXWYRUJCNFI-UHFFFAOYSA-N

InChI

InChI=1S/C6H5Br2N/c7-4-1-2-6(9)5(8)3-4/h1-3H,9H2

Weigh it out

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

Names and synonyms

5 names

Benzenamine, 2,4-dibromo-
Aniline, 2,4-dibromo-
2,4-Dibromobenzenamine
NSC 88324
(2,4-Dibromophenyl)amine

Work with 2,4-Dibromoaniline

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

4-Bromobenzene-1,2-diamine1575-37-765 % similar 1,2,4-Tribromobenzene615-54-357 % similar 4,4'-Dibromobiphenyl-2,2'-diamine136630-36-956 % similar 2-Bromo-4-fluoroaniline1003-98-156 % similar 4-Bromo-2-fluoroaniline367-24-856 % similar 2-Amino-5-bromophenol38191-34-356 % similar 4-Bromo-2-chloroaniline38762-41-356 % similar 2-Bromo-4-methylaniline583-68-656 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Same formula

2,3-Dibromo-6-methylpyridine261373-04-0 2,3-Dibromo-5-methylpyridine29232-39-1 2,5-Dibromo-3-methylpyridine3430-18-0 3,5-Dibromo-4-methylpyridine3430-23-7 2,5-Dibromo-4-methylpyridine3430-26-0 2,5-Dibromoaniline3638-73-1 3,6-Dibromo-2-methylpyridine39919-65-8 2,6-Dibromoaniline608-30-0

Elsewhere

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