CHEBI:229348 - Propane, 2-chloro-2-nitro-

ChEBI IDCHEBI:229348
ChEBI NamePropane, 2-chloro-2-nitro-
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC3H6ClNO2
Net Charge0
Average Mass123.539
Monoisotopic Mass123.00871
SMILESCC(C)(Cl)[N+](=O)[O-]
InChIInChI=1S/C3H6ClNO2/c1-3(2,4)5(6)7/h1-2H3
InChIKeyJQYFSFNSNVRUPY-UHFFFAOYSA-N
Species of MetaboliteComponentSourceComments
Oryctolagus cuniculus (ncbitaxon:9986) longissimus thoracis (BTO:0001651) MetaboLights (MTBLS8958)
ChEBI Ontology
Outgoing Relation(s)
Propane, 2-chloro-2-nitro- (CHEBI:229348) is a C-nitro compound (CHEBI:35716)
IUPAC Name 
2-chloro-2-nitropropane
Manual XrefsDatabases
11183ChemSpider
Registry NumbersSources
CAS:594-71-8ChemIDplus