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CHEBI:67116 - 4-nitro-1,2-phenylenediamine

ChEBI IDCHEBI:67116
ChEBI Name4-nitro-1,2-phenylenediamine
Stars
DefinitionThe primary amino compound that is 1,2-phenylenediamine (o-phenylenediamine) substituted at the 4- (para-) position by a nitro group.
Last Modified28 July 2014
SubmitterMarcus Ennis
DownloadsMolfile
FormulaC6H7N3O2
Net Charge0
Average Mass153.141
Monoisotopic Mass153.05383
SMILESNc1ccc([N+](=O)[O-])cc1N
InChIInChI=1S/C6H7N3O2/c7-5-2-1-4(9(10)11)3-6(5)8/h1-3H,7-8H2
InChIKeyRAUWPNXIALNKQM-UHFFFAOYSA-N
Roles Classification
Chemical Role:
Bronsted base  A molecular entity capable of accepting a hydron from a donor (Brønsted acid).
ChEBI Ontology
Outgoing Relation(s)
4-nitro-1,2-phenylenediamine (CHEBI:67116) has functional parent 1,2-phenylenediamine (CHEBI:34043)
4-nitro-1,2-phenylenediamine (CHEBI:67116) is a C-nitro compound (CHEBI:35716)
4-nitro-1,2-phenylenediamine (CHEBI:67116) is a primary amino compound (CHEBI:50994)
IUPAC Name 
4-nitrobenzene-1,2-diamine
Synonyms  Source
p-nitro-o-phenylenediamineChEBI
4-Nitro-o-phenylenediamineChemIDplus
1,2-Diamino-4-nitrobenzeneChemIDplus
3,4-DiaminonitrobenzeneChemIDplus
4-Nitro-1,2-diaminobenzeneChemIDplus
2-Amino-4-nitroanilineChemIDplus
Manual XrefsDatabases
KR20080065716Patent
C19384KEGG COMPOUND
Registry NumbersSources
Reaxys:608106Reaxys
CAS:99-56-9ChemIDplus
CAS:99-56-9KEGG COMPOUND
Citations