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CHEBI:134862 - clonitrate

ChEBI IDCHEBI:134862
ChEBI Nameclonitrate
Stars
Last Modified23 February 2017
DownloadsMolfile
FormulaC3H5ClN2O6
Net Charge0
Average Mass200.534
Monoisotopic Mass199.98361
SMILES[H]C(CCl)(CO[N+](=O)[O-])O[N+](=O)[O-]
InChIInChI=1S/C3H5ClN2O6/c4-1-3(12-6(9)10)2-11-5(7)8/h3H,1-2H2
InChIKeySUAJWTBTMNHVBZ-UHFFFAOYSA-N
ChEBI Ontology
Outgoing Relation(s)
clonitrate (CHEBI:134862) is a nitrate ester (CHEBI:51080)
Synonyms  Source
dinitrochlorohydrinDrugCentral
dinitrochlorhydrinDrugCentral
Manual XrefsDatabases
3110DrugCentral
Registry NumbersSources
CAS:2612-33-1DrugCentral