3-(N-Methyl-p-(phenylazo)anilino)propionitrile

HCID 147384

Notes Reactions

Substructure search Find similar structures

Basic information

CAS: 31464-26-3
Standard SMILES: CN(CCC#N)c1ccc(N=Nc2ccccc2)cc1
InChIKey: WKRPJRMGCMKTHF-UHFFFAOYSA-N
Molecular formula: C16H16N4
Average molar mass: 264.32 g/mol
Monoisotopic mass: 264.13749653

Names & identifiers

Preferred name: 3-(N-Methyl-p-(phenylazo)anilino)propionitrile
IUPAC: 3-(N-methyl-4-phenyldiazenylanilino)propanenitrile

Names & synonyms

3-(N-Methyl-p-(phenylazo)anilino)propionitrile31464-26-34-(N-(beta-Cyanoethyl)-N-methylamino)azobenzeneCCRIS 51004-[N-(BETA-CYANOETHYL)-N-METHYLAMINO]AZOBENZENEBRN 1915431Propionitrile, 3-(N-methyl-p-(phenylazo)anilino)-Propanenitrile, 3-(methyl(4-(phenylazo)phenyl)amino)-DTXSID501031277

Database identifiers

CAS: 31464-26-3
PubChem CID: 147384
DTXSID: DTXSID501031277

Properties

Computed structural properties

XLogP: 4.3
Topological polar surface area: 51.8 Å²
Hydrogen bond donors: 0
Hydrogen bond acceptors: 4
Rotatable bonds: 5
Heavy atoms: 20
Formal charge: 0
Complexity: 343

Related reactions

0 records

New reaction record

No reaction records under the current filter.

Compound notes

Loading…