CHEBI:48115 - 1,2,4-trinitrobenzene

ChEBI IDCHEBI:48115
ChEBI Name1,2,4-trinitrobenzene
Stars
Last Modified3 February 2011
SubmitterKirill Degtyarenko
DownloadsMolfile
FormulaC6H3N3O6
Net Charge0
Average Mass213.105
Monoisotopic Mass213.00218
SMILESO=[N+]([O-])c1ccc([N+](=O)[O-])c([N+](=O)[O-])c1
InChIInChI=1S/C6H3N3O6/c10-7(11)4-1-2-5(8(12)13)6(3-4)9(14)15/h1-3H
InChIKeyOJJRABFYHOHGGU-UHFFFAOYSA-N
ChEBI Ontology
Outgoing Relation(s)
1,2,4-trinitrobenzene (CHEBI:48115) is a trinitrobenzene (CHEBI:48110)
IUPAC Name 
1,2,4-trinitrobenzene
Synonym  Source
1,2,4-TrinitrobenzolChEBI
Registry NumbersSources
Beilstein:802072Beilstein
CAS:610-31-1NIST Chemistry WebBook
CAS:610-31-1ChemIDplus