chempirical

4-Bromo-N′,N′-dimethylaniline

C8H10BrNCAS 586-77-6200.08 g/mol

Open in Covalent MOL file
NBr
Aryl halideTertiary amine

Properties

Molecular formula
C8H10BrN
Molar mass
200.08 g/mol
Exact mass
198.9997 Da
Melting point
55 °C
Boiling point
264 °C
logP
2.52Crippen estimate
Polar surface area
3.2 Ų
H-bond donors / acceptors
0 / 1
Rotatable bonds
1

Identifiers

CAS number
586-77-6
SMILES
CN(C)c1ccc(Br)cc1
InChIKey
XYZWMVYYUIMRIZ-UHFFFAOYSA-N
InChI
InChI=1S/C8H10BrN/c1-10(2)8-5-3-7(9)4-6-8/h3-6H,1-2H3

Weigh it out

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

Names and synonyms

17 names · show all
  • NSC 8056
  • Benzenamine, 4-bromo-N,N-dimethyl-
  • Aniline, p-bromo-N,N-dimethyl-
  • 4-Bromo-N,N-dimethylbenzenamine
  • 1-Bromo-4-(dimethylamino)benzene
  • 4-Bromo-N,N-dimethylaniline
  • p-Bromo-N,N-dimethylaniline
  • 4-Dimethylaminobromobenzene
  • p-Bromo(dimethylamino)benzene
  • p-Dimethylaminobromobenzene
  • p-(Dimethylamino)phenyl bromide
  • N,N-Dimethyl-p-bromoaniline
  • p-N,N-Dimethylaminobromobenzene
  • N,N-Dimethyl-4-bromoaniline
  • 4-(Dimethylamino)phenyl bromide
  • 4-Dimethylamino-1-bromobenzene
  • (4-Bromophenyl)dimethylamine

Work with 4-Bromo-N′,N′-dimethylaniline

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

Wurster'S blue100-22-167 % similar N,N,N′,N′-Tetramethylbenzidine366-29-057 % similar Tris(4-bromophenyl)amine4316-58-957 % similar Tetramethyl-P-phenylenediamine dihydrochloride637-01-457 % similar Dimethyl-P-toluidine99-97-852 % similar Tetramethyldiaminodiphenylmethane101-61-150 % similar 1,4-Dibromobenzene106-37-650 % similar Dimethylaniline121-69-750 % similar

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

Same formula

(S)-1-(3-Bromophenyl)ethylamine139305-96-7 3-Bromo-N,N-dimethylaniline16518-62-0 1-(4-Bromophenyl)ethylamine24358-62-1 4-Bromo-2,6-dimethylbenzenamine24596-19-8 (αS)-4-Bromo-α-methylbenzenemethanamine27298-97-1 2-Bromo-4,6-dimethylbenzenamine41825-73-4 4-Bromo-2-ethylaniline45762-41-2 (αR)-4-Bromo-α-methylbenzenemethanamine45791-36-4

Elsewhere

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