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CHEBI:64635 - 5-nitroimidazole

ChEBI IDCHEBI:64635
ChEBI Name5-nitroimidazole
Stars
DefinitionA C-nitro compound that is imidazole bearing a nitro substituent at position 5.
Last Modified22 May 2012
SubmitterJane Lomax
DownloadsMolfile
FormulaC3H3N3O2
Net Charge0
Average Mass113.076
Monoisotopic Mass113.02253
SMILESO=[N+]([O-])c1cncn1
InChIInChI=1S/C3H3N3O2/c7-6(8)3-1-4-2-5-3/h1-2H,(H,4,5)
InChIKeyVYDWQPKRHOGLPA-UHFFFAOYSA-N
Wikipedia
ChEBI Ontology
Outgoing Relation(s)
5-nitroimidazole (CHEBI:64635) is a C-nitro compound (CHEBI:35716)
5-nitroimidazole (CHEBI:64635) is a imidazoles (CHEBI:24780)
IUPAC Name 
5-nitro-1H-imidazole
Synonyms  Source
5(4)-nitroimidazoleChEBI
4-nitro-3H-imidazoleChEBI
Manual XrefsDatabases
NitroimidazoleWikipedia
Registry NumbersSources
Reaxys:606969Reaxys
CAS:100214-79-7ChemIDplus