chempirical

2,6-Dibromo-4-methylaniline

C7H7Br2NCAS 6968-24-7264.95 g/mol

Open in Covalent MOL file
BrNH2Br
Aryl halidePrimary amine

Properties

Molecular formula
C7H7Br2N
Molar mass
264.95 g/mol
Exact mass
262.8945 Da
Melting point
79 °C
logP
3.10Crippen estimate
Polar surface area
26.0 Ų
H-bond donors / acceptors
1 / 1
Rotatable bonds
0

Identifiers

CAS number
6968-24-7
SMILES
Cc1cc(Br)c(N)c(Br)c1
InChIKey
ATDIROHVRVQMRO-UHFFFAOYSA-N
InChI
InChI=1S/C7H7Br2N/c1-4-2-5(8)7(10)6(9)3-4/h2-3H,10H2,1H3

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Names and synonyms

8 names
  • Benzenamine, 2,6-dibromo-4-methyl-
  • 2,6-Dibromo-p-toluidine
  • 3,5-Dibromo-4-aminotoluene
  • 2,6-Dibromo-4-toluidine
  • 4-Amino-3,5-dibromotoluene
  • NSC 20674
  • p-Toluidine, 2,6-dibromo-
  • 2,6-Dibromo-4-methylbenzenamine

Work with 2,6-Dibromo-4-methylaniline

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

2-Bromo-4,6-dimethylbenzenamine41825-73-475 % similar 2,4,6-Tribromoaniline147-82-057 % similar 2-Amino-3-bromo-5-methylbenzoic acid13091-43-556 % similar 2-Bromo-4-methyl-6-nitrobenzenamine827-24-756 % similar 2,6-Dibromo-4-methylphenol2432-14-652 % similar 2,6-Dibromo-4-fluoroaniline344-18-352 % similar 2,6-Dibromo-4-chloroaniline874-17-952 % similar 2,6-Dibromo-4-(1-methylethyl)benzenamine10546-65-352 % similar

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

Same formula

2,6-Dibromo-3,5-dimethylpyridine117846-58-9 3,5-Dibromo-4-methylaniline13194-73-5

Elsewhere

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