Search MNXref
 Feedback

2-amino-4,6-dinitrotoluene

PropertiesImage
MNX_IDMNXM3456 Image of MNXM3456
referencechebi:19452
formulaC7H7N3O4
global charge0
mol weight197.15
InChIKeyIEEJAAUSLQCGJH-UHFFFAOYSA-N
InChIInChI=1S/C7H7N3O4/c1-4-6(8)2-5(9(11)12)3-7(4)10(13)14/h2-3H,8H2,1H3
SMILESCC1=C([N+](=O)[O-])C=C([N+](=O)[O-])C=C1N
MNX internals
InChI (mnx)InChI=1/C7H7N3O4/c1-4-6(8)2-5(9(11)12)3-7(4)10(13)14/h2-3H,8H2,1H3 Image of MNXM3456
SMILES (mnx)[CH3:1][C:4]1=[C:6]([NH2:8])[CH:2]=[C:5]([N+:9]([O-:11])=[O:12])[CH:3]=[C:7]1[N+:10]([O-:13])=[O:14]
Parent-child relations graph
Occurences in reactions#reac
in my sandbox 0
in MNXref (generic)8
in models (compartimentalized) 0
Similar chemical compounds in external resources
IdentifierDescription

CHEBI:19452
chebi:19452
IEEJAAUSLQCGJH-UHFFFAOYSA-N 		2-amino-4,6-dinitrotoluene
2,4-Dinitro-6-aminotoluene
2-Adnt
2-Methyl-3,5-dinitrobenzenamine
2-methyl-3,5-dinitroaniline
3,5-Dinitro-o-toluidine

envipath:...d7cba887285b
envipathM:...d7cba887285b
kegg.compound:C16395
keggC:C16395
IEEJAAUSLQCGJH-UHFFFAOYSA-N 		2-Amino-4,6-dinitrotoluene
hmdb:HMDB0245219
IEEJAAUSLQCGJH-UHFFFAOYSA-N 		2-Amino-4,6-dinitrotoluene
2,4-Dinitro-6-aminotoluene
2-Adnt
2-Methyl-3,5-dinitrobenzenamine
2-amino-4,6-dinitrotoluene
2-methyl-3,5-dinitroaniline
3,5-Dinitro-O-toluidine

seed.compound:cpd15101
seedM:cpd15101
IEEJAAUSLQCGJH-UHFFFAOYSA-N 		2-Amino-4,6-dinitrotoluene
2-ADNT
2-amino-4,6-dinitrotoluene

metacyc.compound:CPD-10450
metacycM:CPD-10450
IEEJAAUSLQCGJH-UHFFFAOYSA-O 		2-amino-4,6-dinitrotoluene
2-ADNT

keggC:M_C16395
seedM:M_cpd15101 		secondary/obsolete/fantasy identifier