CHEBI:75648 - 4-(4-nitrophenylazo)aniline

ChEBI IDCHEBI:75648
ChEBI Name4-(4-nitrophenylazo)aniline
Stars
DefinitionAzobenzene substituted at the phenyl 4-positions by an amino and a nitro group.
Last Modified12 March 2019
SubmitterMarcus Ennis
DownloadsMolfile
FormulaC12H10N4O2
Net Charge0
Average Mass242.238
Monoisotopic Mass242.08038
SMILESNc1ccc(N=Nc2ccc([N+](=O)[O-])cc2)cc1
InChIInChI=1S/C12H10N4O2/c13-9-1-3-10(4-2-9)14-15-11-5-7-12(8-6-11)16(17)18/h1-8H,13H2
InChIKeyUNBOSJFEZZJZLR-UHFFFAOYSA-N
Roles Classification
Chemical Role:
Bronsted base  A molecular entity capable of accepting a hydron from a donor (Brønsted acid).
Biological Role:
allergen  A chemical compound, or part thereof, which causes the onset of an allergic reaction by interacting with any of the molecular pathways involved in an allergy.
Application:
dye 
ChEBI Ontology
Outgoing Relation(s)
4-(4-nitrophenylazo)aniline (CHEBI:75648) has functional parent azobenzene (CHEBI:190358)
4-(4-nitrophenylazo)aniline (CHEBI:75648) has role allergen (CHEBI:50904)
4-(4-nitrophenylazo)aniline (CHEBI:75648) has role dye (CHEBI:37958)
4-(4-nitrophenylazo)aniline (CHEBI:75648) is a azobenzenes (CHEBI:22682)
4-(4-nitrophenylazo)aniline (CHEBI:75648) is a primary arylamine (CHEBI:50471)
IUPAC Name 
4-[(4-nitrophenyl)diazenyl]aniline
Synonyms  Source
Disperse orange 3ChemIDplus
4-[(4-Nitrophenyl)azo]benzenaminChemIDplus
4-(2-(4-nitrophenyl)diazenyl)benzenamineChemIDplus
4-((nitrophenyl)azo)benzeneamineChemIDplus
4-[(4-nitrophenyl)azo]benzenamineChemIDplus
4-((4-nitrophenyl)diazenyl)anilineChEBI
Registry NumbersSources
Reaxys:749369Reaxys
CAS:730-40-5ChemIDplus
CAS:730-40-5NIST Chemistry WebBook
Citations