CHEBI:63569 - N-isopropyl-N'-phenyl-p-phenylenediamine

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name N-isopropyl-N'-phenyl-p-phenylenediamine
ChEBI ID CHEBI:63569
ChEBI ASCII Name N-isopropyl-N'-phenyl-p-phenylenediamine
Definition The N-substituted diamine that is 1,4-phenylenediamine substituted at one N with an isopropyl group and at the other with a phenyl group.
Stars This entity has been manually annotated by the ChEBI Team.
Supplier Information
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Formula C15H18N2
Net Charge 0
Average Mass 226.31680
Monoisotopic Mass 226.14700
InChI InChI=1S/C15H18N2/c1-12(2)16-14-8-10-15(11-9-14)17-13-6-4-3-5-7-13/h3-12,16-17H,1-2H3
InChIKey OUBMGJOQLXMSNT-UHFFFAOYSA-N
SMILES CC(C)Nc1ccc(Nc2ccccc2)cc1
Roles Classification
Chemical Role(s): antioxidant
A substance that opposes oxidation or inhibits reactions brought about by dioxygen or peroxides.
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.
View more via ChEBI Ontology
ChEBI Ontology
Outgoing N-isopropyl-N'-phenyl-p-phenylenediamine (CHEBI:63569) has role allergen (CHEBI:50904)
N-isopropyl-N'-phenyl-p-phenylenediamine (CHEBI:63569) has role antioxidant (CHEBI:22586)
N-isopropyl-N'-phenyl-p-phenylenediamine (CHEBI:63569) is a N-substituted diamine (CHEBI:50441)
IUPAC Name
N-isopropyl-N'-phenylbenzene-1,4-diamine
Synonyms Sources
-Isopropylaminodiphenylamine ChemIDplus
4-(Isopropylamino)diphenylamine ChemIDplus
4-Anilino-N-isopropylaniline ChemIDplus
IPPD ChEBI
N-(1-methylethyl)-N'-phenyl-1,4-benzenediamine NIST Chemistry WebBook
N-isopropyl-N'-phenyl-1,4-phenylenediamine ChEBI
Registry Numbers Types Sources
101-72-4 CAS Registry Number NIST Chemistry WebBook
101-72-4 CAS Registry Number ChemIDplus
2213195 Reaxys Registry Number Reaxys
Citations Waiting for Citations Types Sources
19338586 PubMed citation Europe PMC
21616561 PubMed citation Europe PMC
7204095 PubMed citation Europe PMC
8156758 PubMed citation Europe PMC
8384542 PubMed citation Europe PMC
8462307 PubMed citation Europe PMC
Last Modified
12 January 2012