chempirical

Pentadienedianiline hydrochloride

C17H17ClN2CAS 1497-49-0284.79 g/mol

Open in Covalent MOL file
NHNHCl
AlkeneImineSecondary amine

Properties

Molecular formula
C17H17ClN2
Molar mass
284.79 g/mol
Exact mass
284.1080 Da
Melting point
145–146 °C
logP
4.99Crippen estimate
Polar surface area
24.4 Ų
H-bond donors / acceptors
1 / 2
Rotatable bonds
5

Identifiers

CAS number
1497-49-0
SMILES
C(=CC=Nc1ccccc1)C=CNc1ccccc1.Cl
InChIKey
VUCMMJBDNXZQDJ-UHFFFAOYSA-N
InChI
InChI=1S/C17H16N2.ClH/c1-4-10-16(11-5-1)18-14-8-3-9-15-19-17-12-6-2-7-13-17;/h1-15,18H;1H

Weigh it out

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

Names and synonyms

10 names
  • Benzenamine, N-[5-(phenylamino)-2,4-pentadien-1-ylidene]-, hydrochloride (1:1)
  • Aniline, N,N′-1,3-pentadien-1-yl-5-ylidenedi-, monohydrochloride
  • Benzenamine, N-[5-(phenylamino)-2,4-pentadienylidene]-, monohydrochloride
  • Aniline, N,N′-1,3-pentadien-1-yl-5-ylidenedi-, hydrochloride
  • Glutaconaldehyde dianilide hydrochloride
  • Glutaconaldehyde dianil chloride
  • Glutaconic aldehyde dianil hydrochloride
  • 1-Phenylamino-5-phenylimino-1,3-pentadiene hydrochloride
  • Glutacondianil hydrochloride
  • Glutaconaldehydedianyl hydrochloride

Work with Pentadienedianiline hydrochloride

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

1-Anilino-3-phenylimino-1-propene hydrochloride50328-50-287 % similar N,N′-Diphenylmethanimidamide622-15-150 % similar N-[(3-(Anilinomethylene)-2-chloro-1-cyclohexen-1-yl)methylene]aniline monohydrochloride63857-00-138 % similar Diphenylammonium chloride537-67-736 % similar 4-(Phenylazo)diphenylamine101-75-735 % similar Phenylhydrazine hydrochloride59-88-134 % similar Formanilide103-70-833 % similar 4-Nitrosodiphenylamine156-10-533 % similar

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

Elsewhere

PubChem CAS Common Chemistry NIST WebBook