2-amino-4,6-dinitrotoluene

Chemical Formula:

C₇H₈N₃O₄

Molecular Weight:

198.158 Daltons

Monoisotopic Mass:

200.067130825 Daltons

SMILES:

CC1(C([N+])=CC([N+](=O)[O-])=CC([N+]([O-])=O)=1)

InChI:

1S/C7H7N3O4/c1-4-6(8)2-5(9(11)12)3-7(4)10(13)14/h2-3H,8H2,1H3/p+1

InChIKey:

IEEJAAUSLQCGJH-UHFFFAOYSA-O

Synonyms

Databases

MetaCyc: CPD-10450

PubChem (CID): 90658867

MetaboLights: MTBLC19452

UMBBD-Compounds: c0459

ChEBI: 19452

ChemSpider: 34123

KEGG: C16395

Seed: cpd15101

MetaNetX: MNXM3456