MetaNetX
Automated Model Construction and Genome Annotation for Large-Scale Metabolic Networks

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N,N-dimethyl-1,4-phenylenediamine

	Properties	Image
MNX_ID	MNXM3664
reference	chebi:15783
formula	C₈H₁₂N₂
global charge	0
mol weight	136.198
InChIKey	BZORFPDSXLZWJF-UHFFFAOYSA-N
InChI	InChI=1S/C8H12N2/c1-10(2)8-5-3-7(9)4-6-8/h3-6H,9H2,1-2H3
SMILES	CN(C)C1=CC=C(N)C=C1

MNX internals

InChI (mnx)	InChI=1/C8H12N2/c1-10(2)8-5-3-7(9)4-6-8/h3-6H,9H2,1-2H3
SMILES (mnx)	[CH3:1][N:10]([CH3:2])[C:8]1=[CH:6][CH:4]=[C:7]([NH2:9])[CH:3]=[CH:5]1

Parent-child relations graph

Occurences in reactions	#reac
in my sandbox	0
in MNXref (generic)	16
in models (compartimentalized)	1

Similar chemical compounds in external resources
Identifier	Description
CHEBI:15783 chebi:15783 BZORFPDSXLZWJF-UHFFFAOYSA-N	N,N-dimethyl-1,4-phenylenediamine N,N-Dimethyl-1,4-phenylenediamine N,N-Dimethyl-p-phenylenediamine N,N-dimethyl-p-phenylenediamine N,N-dimethylbenzene-1,4-diamine p-Amino-N,N-dimethylaniline p-amino-N,N-dimethylaniline
sabiork.compound:7149 sabiorkM:7149 BZORFPDSXLZWJF-UHFFFAOYSA-N	N,N-Dimethyl-1,4-phenylenediamine 4-Amino-N,N-dimethylaniline N,N-Dimethyl-p-phenylenediamine p-Amino-N,N-dimethylaniline
kegg.compound:C04203 keggC:C04203 BZORFPDSXLZWJF-UHFFFAOYSA-N	N,N-Dimethyl-1,4-phenylenediamine N,N-Dimethyl-p-phenylenediamine p-Amino-N,N-dimethylaniline
hmdb:HMDB0247696 BZORFPDSXLZWJF-UHFFFAOYSA-N	N,N-Dimethyl-p-phenylenediamine N,N-Dimethyl-P-phenylenediamine N1,N1-dimethylbenzene-1,4-diamine dimethyl-p-phenylenediamine p-Amino-N,N-dimethylaniline
metacyc.compound:CPD0-1148 metacycM:CPD0-1148 BZORFPDSXLZWJF-UHFFFAOYSA-N	N,N-dimethyl-1,4-phenylenediamine DMPD N,N-dimethyl-p-phenylenediamine dimethyl-4-phenylenediamine
seed.compound:cpd02581 seedM:cpd02581 BZORFPDSXLZWJF-UHFFFAOYSA-N	p-Amino-N,N-dimethylaniline DMPD N,N'-dimethyl-p-phenylenediamine N,N-Dimethyl-1,4-phenylenediamine N,N-Dimethyl-p-phenylenediamine N,N-dimethyl-1,4-phenylenediamine N,N-dimethyl-p-phenylenediamine dimethyl-4-phenylenediamine
chebi:12422 chebi:12533 chebi:21450 chebi:7073 keggC:M_C04203 seedM:M_cpd02581	secondary/obsolete/fantasy identifier