chempirical

4-(Phenylazo)diphenylamine

C18H15N3CAS 101-75-7273.34 g/mol

Open in Covalent MOL file
NNNH
AzoSecondary amine

Properties

Molecular formula
C18H15N3
Molar mass
273.34 g/mol
Exact mass
273.1266 Da
Melting point
80–81 °C
logP
5.85Crippen estimate
Polar surface area
36.8 Ų
H-bond donors / acceptors
1 / 3
Rotatable bonds
4

Identifiers

CAS number
101-75-7
SMILES
c1ccc(N=Nc2ccc(Nc3ccccc3)cc2)cc1
InChIKey
VXLFYNFOITWQPM-UHFFFAOYSA-N
InChI
InChI=1S/C18H15N3/c1-3-7-15(8-4-1)19-16-11-13-18(14-12-16)21-20-17-9-5-2-6-10-17/h1-14,19H

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Names and synonyms

11 names
  • Benzenamine, N-phenyl-4-(2-phenyldiazenyl)-
  • Diphenylamine, 4-(phenylazo)-
  • Benzenamine, N-phenyl-4-(phenylazo)-
  • N-Phenyl-4-(2-phenyldiazenyl)benzenamine
  • N-Phenyl-4-aminoazobenzene
  • 4-Anilinoazobenzene
  • 4-(Phenylamino)azobenzene
  • 4-Phenazodiphenylamine
  • NSC 74774
  • N-Phenyl-4-(phenylazo)benzenamine
  • N-Phenyl-4-(phenylazo)aniline

Work with 4-(Phenylazo)diphenylamine

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

N,N′-Diphenyl-P-phenylenediamine74-31-765 % similar 4-Nitrosodiphenylamine156-10-562 % similar Acid orange 5554-73-461 % similar Azobenzene103-33-360 % similar Diphenylamine122-39-460 % similar Diphenylbenzidine531-91-957 % similar Metanil yellow587-98-454 % similar Diphenylammonium chloride537-67-752 % similar

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

Elsewhere

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