CHEBI:83474 - flufenacet OXA

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ChEBI Name flufenacet OXA
ChEBI ID CHEBI:83474
Definition A monocarboxylic acid that is oxoacetic acid substituted by a (4-fluorophenyl)(propan-2-yl)amino group at position 2. It is a metabolite of the herbicide flufenacet.
Stars This entity has been manually annotated by the ChEBI Team.
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Formula C11H12FNO3
Net Charge 0
Average Mass 225.21630
Monoisotopic Mass 225.08012
InChI InChI=1S/C11H12FNO3/c1-7(2)13(10(14)11(15)16)9-5-3-8(12)4-6-9/h3-7H,1-2H3,(H,15,16)
InChIKey FFKNXXCOXIZLJD-UHFFFAOYSA-N
SMILES CC(C)N(C(=O)C(O)=O)c1ccc(F)cc1
Roles Classification
Chemical Role(s): Bronsted acid
A molecular entity capable of donating a hydron to an acceptor (Bronsted base).
(via oxoacid )
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ChEBI Ontology
Outgoing flufenacet OXA (CHEBI:83474) is a aromatic amide (CHEBI:62733)
flufenacet OXA (CHEBI:83474) is a monocarboxylic acid (CHEBI:25384)
flufenacet OXA (CHEBI:83474) is a monofluorobenzenes (CHEBI:83575)
IUPAC Name
[(4-fluorophenyl)(propan-2-yl)amino](oxo)acetic acid
Last Modified
10 November 2014