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CHEBI:34043 - 1,2-phenylenediamine

Default Structure
ChEBI IDCHEBI:34043
ChEBI Name1,2-phenylenediamine
Stars
DefinitionA phenylenediamine in which the two amino groups are ortho to each other.
Last Modified1 June 2016
DownloadsMolfile
FormulaC6H8N2
Net Charge0
Average Mass108.144
Monoisotopic Mass108.06875
SMILESNc1ccccc1N
InChIInChI=1S/C6H8N2/c7-5-3-1-2-4-6(5)8/h1-4H,7-8H2
InChIKeyGEYOCULIXLDCMW-UHFFFAOYSA-N
Wikipedia
Roles Classification
Chemical Roles:
electron donor  A molecular entity that can transfer an electron to another molecular entity.
Bronsted base  A molecular entity capable of accepting a hydron from a donor (Brønsted acid).
ChEBI Ontology
Outgoing Relation(s)
1,2-phenylenediamine (CHEBI:34043) has parent hydride benzene (CHEBI:16716)
1,2-phenylenediamine (CHEBI:34043) is a hydrogen donor (CHEBI:17499)
1,2-phenylenediamine (CHEBI:34043) is a phenylenediamine (CHEBI:51402)
Incoming Relation(s)
4-nitro-1,2-phenylenediamine (CHEBI:67116) has functional parent 1,2-phenylenediamine (CHEBI:34043)
benzimidazole precursor fungicide (CHEBI:87037) has functional parent 1,2-phenylenediamine (CHEBI:34043)
entinostat (CHEBI:132082) has functional parent 1,2-phenylenediamine (CHEBI:34043)
JSH-23 (CHEBI:131326) has functional parent 1,2-phenylenediamine (CHEBI:34043)
tacedinaline (CHEBI:90195) has functional parent 1,2-phenylenediamine (CHEBI:34043)
thiophanate (CHEBI:82060) has functional parent 1,2-phenylenediamine (CHEBI:34043)
thiophanate-methyl (CHEBI:35014) has functional parent 1,2-phenylenediamine (CHEBI:34043)
IUPAC Name 
benzene-1,2-diamine
Synonyms  Source
1,2-DiaminobenzeneKEGG COMPOUND
2-AminoanilineChemIDplus
2-Phenylene diamineKEGG COMPOUND
OPDAChemIDplus
o-PhenylenediamineKEGG COMPOUND
phenylene-1,2-dimaineChEBI
Manual XrefsDatabases
C14402KEGG COMPOUND
O-PhenylenediamineWikipedia
Registry NumbersSources
Reaxys:606074Reaxys
CAS:95-54-5KEGG COMPOUND
CAS:95-54-5ChemIDplus
CAS:95-54-5NIST Chemistry WebBook
Citations