3,4-dinitrotolueneImported
A dinitrotoluene in which the methyl group is meta to one of the nitro groups and para to the other. A uellow crystalline compound that is virtually insoluble in water but dissolves in most organic solvents.
Defined bychebi
Exact Synonyms
3,4-dinitrotoluene
4-methyl-1,2-dinitrobenzene
Related Synonyms
1-methyl-3,4-dinitrobenzene
3,4-DNT
class Information
charge
0
formula
C7H6N2O4
has_dbxref
- CAS:610-39-9
- MetaCyc:CPD-18110
- PMID:11823201
- PMID:12776928
- PMID:15568688
- PMID:21215986
- PMID:22422434
- PMID:7525201
- Reaxys:2213131
has_obo_namespace
chebi_ontology
inchi
InChI=1S/C7H6N2O4/c1-5-2-3-6(8(10)11)7(4-5)9(12)13/h2-4H,1H3
inchikey
INYDMNPNDHRJQJ-UHFFFAOYSA-N
in_subset
mass
182.134
monoisotopicmass
182.03276
smiles
C1=C(C(=CC=C1C)[N+]([O-])=O)[N+](=O)[O-]