MetaADEDB 2.0 @ LMMD
4-amino-2,6-dinitrotoluene
(KQRJATLINVYHEZ-UHFFFAOYSA-N)
Structure
SMILES
Nc1cc([N+](=O)[O-])c(c(c1)[N+](=O)[O-])C
Molecular Formula:
C7H7N3O4
Molecular Weight:
197.148
Log P:
3.0212
Hydrogen Bond Acceptor:
1
Hydrogen Bond Donor:
1
TPSA:
117.66
CAS Number(s):
19406-51-0; 58449-89-1; 153919-64-3
Synonym(s)
1.
4-amino-2,6-dinitrotoluene
2.
2,6-dinitro-4-aminotoluene
3.
4-methyl-3,5-dinitroaniline
External Link(s)
MeSHC035207
PubChem Compound29574
ChEBI77424
KEGGcpd:C16394
ZINC4245385
Adverse Drug Event(s)
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