Chemical Component Summary

Name4,5-DIMETHYL-1,2-PHENYLENEDIAMINE
Identifiers4,5-dimethylbenzene-1,2-diamine
FormulaC8 H12 N2
Molecular Weight136.194
TypeNON-POLYMER
Isomeric SMILESCc1cc(c(cc1C)N)N
InChIInChI=1S/C8H12N2/c1-5-3-7(9)8(10)4-6(5)2/h3-4H,9-10H2,1-2H3
InChIKeyXSZYBMMYQCYIPC-UHFFFAOYSA-N

Chemical Details

Formal Charge0
Atom Count22
Chiral Atom Count0
Bond Count22
Aromatic Bond Count6

Drug Info: DrugBank

DrugBank IDDB03180 
Name4,5-Dimethyl-1,2-phenylenediamine
Groups experimental
Synonyms
  • 4,5-Dimethyl-o-phenylenediamine
  • 4,5-Dimethyl-1,2-phenylenediamine
Categories
  • Amines
  • Aniline Compounds
  • Diamines
  • Polyamines
CAS number3171-45-7

Drug Targets

NameTarget SequencePharmacological ActionActions
Nicotinate-nucleotide--dimethylbenzimidazole phosphoribosyltransferaseMQTLHALLRDIPAPDAEAMARAQQHIDGLLKPPGSLGRLETLAVQLAGMP...unknown
Drug Info/Drug Targets: DrugBank 3.0: a comprehensive resource for 'omics' research on drugs. Knox C, Law V, Jewison T, Liu P, Ly S, Frolkis A, Pon A, Banco K, Mak C, Neveu V, Djoumbou Y, Eisner R, Guo AC, Wishart DS. Nucleic Acids Res. 2011 Jan; 39 (Database issue):D1035-41. | PMID:21059682

Related Resource References

Resource NameReference
PubChem 76635
CCDC/CSD GOGWEG