CHEBI:53613 - 2,5-dimethyl-p-phenylenediamine

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ChEBI Name 2,5-dimethyl-p-phenylenediamine
ChEBI ID CHEBI:53613
ChEBI ASCII Name 2,5-dimethyl-p-phenylenediamine
Definition A primary arylamine that is p-xylene substituted at the 2 and 5 positions by amino groups. It is formally a reduction product of 2,5-dimethyl-1,4-benzoquinonediimine.
Stars This entity has been manually annotated by the ChEBI Team.
Supplier Information
Download Molfile XML SDF
Formula C8H12N2
Net Charge 0
Average Mass 136.19430
Monoisotopic Mass 136.10005
InChI InChI=1S/C8H12N2/c1-5-3-8(10)6(2)4-7(5)9/h3-4H,9-10H2,1-2H3
InChIKey BWAPJIHJXDYDPW-UHFFFAOYSA-N
SMILES Cc1cc(N)c(C)cc1N
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.
View more via ChEBI Ontology
ChEBI Ontology
Outgoing 2,5-dimethyl-p-phenylenediamine (CHEBI:53613) has parent hydride p-xylene (CHEBI:27417)
2,5-dimethyl-p-phenylenediamine (CHEBI:53613) has role allergen (CHEBI:50904)
2,5-dimethyl-p-phenylenediamine (CHEBI:53613) is a primary arylamine (CHEBI:50471)
IUPAC Name
2,5-dimethylbenzene-1,4-diamine
Synonyms Sources
1,4-dimethylphenylene-2,5-diamine ChEBI
2,5-dimethyl-1,4-benzoquinonediamine ChEBI
2,5-dimethyl-para-phenylenediamine ChEBI
2,5-dimethylphenylene-1,4-diamine ChEBI
4-Amino-2,5-dimethylaniline ChemIDplus
Registry Numbers Types Sources
2802422 Beilstein Registry Number Beilstein
2802422 Reaxys Registry Number Reaxys
6393-01-7 CAS Registry Number ChemIDplus
Citations Waiting for Citations Types Sources
19469519 PubMed citation Europe PMC
23153356 PubMed citation Europe PMC
Last Modified
12 March 2019