2,6-Dibromoaniline
Properties
- Molecular formula
- C6H5Br2N
- Molar mass
- 250.92 g/mol
- Exact mass
- 248.8789 Da
- Density
- 1.76 g/mL
- Melting point
- 87.5 °C
- Boiling point
- 263 °C
- logP
- 2.79Crippen estimate
- Polar surface area
- 26.0 Ų
- H-bond donors / acceptors
- 1 / 1
- Rotatable bonds
- 0
Identifiers
CAS number
608-30-0SMILES
Nc1c(Br)cccc1BrInChIKey
XIRRDAWDNHRRLB-UHFFFAOYSA-NInChI
InChI=1S/C6H5Br2N/c7-4-2-1-3-5(8)6(4)9/h1-3H,9H2Weigh it out
Type any one amount. The others follow from the molar mass and density.
Names and synonyms
4 names
- Benzenamine, 2,6-dibromo-
- Aniline, 2,6-dibromo-
- 2,6-Dibromobenzenamine
- NSC 305
Work with 2,6-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
2-Amino-3-bromophenol116435-77-964 % similar
2-Bromo-6-fluorobenzenamine65896-11-964 % similar
2-Amino-3-bromobenzonitrile114344-60-456 % similar
2,6-Dibromo-4-chloroaniline874-17-955 % similar
2,4,6-Tribromoaniline147-82-052 % similar
2-Amino-3-bromobenzoic acid20776-51-650 % similar
2-Bromo-6-nitrobenzenamine59255-95-750 % similar
2,6-Dibromo-4-fluoroaniline344-18-348 % similar
Tanimoto similarity of circular fingerprints over the whole catalogue. All similar compounds