CHEBI:60702 - (2,2,2-trifluoroethoxy)acetic acid

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name (2,2,2-trifluoroethoxy)acetic acid
ChEBI ID CHEBI:60702
Definition An organofluorine compound consisting of acetic acid carrying a 2-(2,2,2-trifluoroethoxy) substituent.
Stars This entity has been manually annotated by the ChEBI Team.
Supplier Information
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Formula C4H5F3O3
Net Charge 0
Average Mass 158.07590
Monoisotopic Mass 158.01908
InChI InChI=1S/C4H5F3O3/c5-4(6,7)2-10-1-3(8)9/h1-2H2,(H,8,9)
InChIKey ICSOIMDWVVEKBW-UHFFFAOYSA-N
SMILES OC(=O)COCC(F)(F)F
ChEBI Ontology
Outgoing (2,2,2-trifluoroethoxy)acetic acid (CHEBI:60702) has functional parent acetic acid (CHEBI:15366)
(2,2,2-trifluoroethoxy)acetic acid (CHEBI:60702) is a organofluorine compound (CHEBI:37143)
Incoming (2,2,2-trifluoroethoxy)acetyl group (CHEBI:60671) is substituent group from (2,2,2-trifluoroethoxy)acetic acid (CHEBI:60702)
IUPAC Name
(2,2,2-trifluoroethoxy)acetic acid
Synonyms Sources
(2,2,2-Trifluorethoxy)essigsäure ChEBI
(2,2,2-trifluoroethoxy)ethanoic acid ChEBI
Manual Xref Database
GB873244 Patent
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Registry Number Type Source
1858842 Reaxys Registry Number Reaxys
Last Modified
30 November 2010