chempirical

2,4,6-Tribromoaniline

C6H4Br3NCAS 147-82-0329.82 g/mol

Open in Covalent MOL file
H2NBrBrBr
Aryl halidePrimary amine

Properties

Molecular formula
C6H4Br3N
Molar mass
329.82 g/mol
Exact mass
326.7894 Da
Density
2.35 g/mL
Melting point
120–122 °C
Boiling point
300 °C
logP
3.56Crippen estimate
Polar surface area
26.0 Ų
H-bond donors / acceptors
1 / 1
Rotatable bonds
0

Identifiers

CAS number
147-82-0
SMILES
Nc1c(Br)cc(Br)cc1Br
InChIKey
GVPODVKBTHCGFU-UHFFFAOYSA-N
InChI
InChI=1S/C6H4Br3N/c7-3-1-4(8)6(10)5(9)2-3/h1-2H,10H2

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Names and synonyms

6 names
  • Benzenamine, 2,4,6-tribromo-
  • Aniline, 2,4,6-tribromo-
  • 2,4,6-Tribromobenzenamine
  • Sym-Tribromoaniline
  • NSC 2216
  • 2,4,6-Tribromo-phenylamine

Work with 2,4,6-Tribromoaniline

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

2,4-Dibromo-6-fluoroaniline141474-37-567 % similar 2,4-Dibromo-6-chloroaniline874-18-067 % similar 2-Amino-3,5-dibromobenzenemethanol50739-76-959 % similar 2-Amino-3,5-dibromobenzaldehyde50910-55-959 % similar 2,6-Dibromo-4-fluoroaniline344-18-357 % similar 2,6-Dibromo-4-methylaniline6968-24-757 % similar 2,6-Dibromo-4-chloroaniline874-17-957 % similar 2-Amino-3,5-dibromobenzoic acid609-85-853 % similar

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

Elsewhere

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