CHEBI:59038 - p-aminodiphenylamine

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ChEBI Name p-aminodiphenylamine
ChEBI ID CHEBI:59038
ChEBI ASCII Name p-aminodiphenylamine
Definition An aromatic amine that is the 4-amino derivative of diphenylamine.
Stars This entity has been manually annotated by the ChEBI Team.
Supplier Information
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Formula C12H12N2
Net Charge 0
Average Mass 184.23710
Monoisotopic Mass 184.10005
InChI InChI=1S/C12H12N2/c13-10-6-8-12(9-7-10)14-11-4-2-1-3-5-11/h1-9,14H,13H2
InChIKey ATGUVEKSASEFFO-UHFFFAOYSA-N
SMILES Nc1ccc(Nc2ccccc2)cc1
Roles Classification
Chemical Role(s): Bronsted base
A molecular entity capable of accepting a hydron from a donor (Bronsted acid).
(via organic amino compound )
Biological Role(s): allergen
A chemical compound, or part thereof, which causes the onset of an allergic reaction by interacting with any of the molecular pathways involved in an allergy.
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ChEBI Ontology
Outgoing p-aminodiphenylamine (CHEBI:59038) has functional parent diphenylamine (CHEBI:4640)
p-aminodiphenylamine (CHEBI:59038) has role allergen (CHEBI:50904)
p-aminodiphenylamine (CHEBI:59038) is a aromatic amine (CHEBI:33860)
p-aminodiphenylamine (CHEBI:59038) is a secondary amino compound (CHEBI:50995)
Incoming N,N'-diphenyl-1,4-phenylenediamine (CHEBI:34860) has functional parent p-aminodiphenylamine (CHEBI:59038)
IUPAC Name
N-phenylbenzene-1,4-diamine
Synonyms Sources
4-Aminodiphenylamine ChemIDplus
Azosalt R ChemIDplus
Luxan Black R ChemIDplus
N, 4'-Bianiline ChemIDplus
N-(4-Aminophenyl)aniline ChemIDplus
N-4'-Bianiline ChemIDplus
N-Phenyl-1,4-benzenediamine ChemIDplus
N-Phenyl-1,4-phenylenediamine ChemIDplus
N-Phenyl-p-aminoaniline ChemIDplus
N-Phenyl-p-phenylenediamine ChemIDplus
p-(Phenylamino)aniline ChemIDplus
p-Aminodiphenylamine ChemIDplus
p-Anilinoaniline ChemIDplus
p-Semidine ChEBI
Registry Numbers Types Sources
101-54-2 CAS Registry Number ChemIDplus
101-54-2 CAS Registry Number NIST Chemistry WebBook
241334 Gmelin Registry Number Gmelin
908935 Reaxys Registry Number Reaxys
908935 Beilstein Registry Number Beilstein
Citations Waiting for Citations Types Sources
23973574 PubMed citation Europe PMC
9874021 PubMed citation Europe PMC
Last Modified
12 March 2019