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CHEBI:60635 - 2-nitro-1-(2-trifluoromethoxyphenyl)ethanone

ChEBI IDCHEBI:60635
ChEBI Name2-nitro-1-(2-trifluoromethoxyphenyl)ethanone
Stars
DefinitionEthanone substituted at C-1 by a (2-trifluoromethoxyphenyl group and at C-2 by a nitro group.
Last Modified16 November 2010
DownloadsMolfile
FormulaC9H6F3NO4
Net Charge0
Average Mass249.144
Monoisotopic Mass249.02489
SMILESO=C(C[N+](=O)[O-])c1ccccc1OC(F)(F)F
InChIInChI=1S/C9H6F3NO4/c10-9(11,12)17-8-4-2-1-3-6(8)7(14)5-13(15)16/h1-4H,5H2
InChIKeyYATRFQSUJUXJHD-UHFFFAOYSA-N
ChEBI Ontology
Outgoing Relation(s)
2-nitro-1-(2-trifluoromethoxyphenyl)ethanone (CHEBI:60635) is a C-nitro compound (CHEBI:35716)
2-nitro-1-(2-trifluoromethoxyphenyl)ethanone (CHEBI:60635) is a organofluorine compound (CHEBI:37143)
IUPAC Name 
2-nitro-1-[2-(trifluoromethoxy)phenyl]ethanone
Brand Name  Source
EMD 335823SUBMITTER
Registry NumbersSources
Reaxys:13834061Reaxys
CAS:216584-50-8SUBMITTER