CHEBI:39319 - 3-(2-chloro-3,3,3-trifluoroprop-1-en-1-yl)-2,2-dimethylcyclopropanecarboxylic acid

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ChEBI Name 3-(2-chloro-3,3,3-trifluoroprop-1-en-1-yl)-2,2-dimethylcyclopropanecarboxylic acid
ChEBI ID CHEBI:39319
Definition An organofluorine compound consisting of cyclopropanecarboxylic acid having a 2-chloro-3,3,3-trifluoroprop-1-en-1-yl group at the 3-position and two methyl groups at the 2-position.
Stars This entity has been manually annotated by the ChEBI Team.
Supplier Information
Download Molfile XML SDF
Formula C9H10ClF3O2
Net Charge 0
Average Mass 242.62241
Monoisotopic Mass 242.03214
InChI InChI=1S/C9H10ClF3O2/c1-8(2)4(6(8)7(14)15)3-5(10)9(11,12)13/h3-4,6H,1-2H3,(H,14,15)
InChIKey SPVZAYWHHVLPBN-UHFFFAOYSA-N
SMILES CC1(C)C(C=C(Cl)C(F)(F)F)C1C(O)=O
Roles Classification
Chemical Role(s): Bronsted acid
A molecular entity capable of donating a hydron to an acceptor (Bronsted base).
(via oxoacid )
View more via ChEBI Ontology
ChEBI Ontology
Outgoing 3-(2-chloro-3,3,3-trifluoroprop-1-en-1-yl)-2,2-dimethylcyclopropanecarboxylic acid (CHEBI:39319) has functional parent cyclopropanecarboxylic acid (CHEBI:23500)
3-(2-chloro-3,3,3-trifluoroprop-1-en-1-yl)-2,2-dimethylcyclopropanecarboxylic acid (CHEBI:39319) is a monocarboxylic acid (CHEBI:25384)
3-(2-chloro-3,3,3-trifluoroprop-1-en-1-yl)-2,2-dimethylcyclopropanecarboxylic acid (CHEBI:39319) is a organochlorine compound (CHEBI:36683)
3-(2-chloro-3,3,3-trifluoroprop-1-en-1-yl)-2,2-dimethylcyclopropanecarboxylic acid (CHEBI:39319) is a organofluorine compound (CHEBI:37143)
Incoming cyhalothrin (CHEBI:4035) has functional parent 3-(2-chloro-3,3,3-trifluoroprop-1-en-1-yl)-2,2-dimethylcyclopropanecarboxylic acid (CHEBI:39319)
IUPAC Name
3-(2-chloro-3,3,3-trifluoroprop-1-en-1-yl)-2,2-dimethylcyclopropanecarboxylic acid
Synonym Source
3-(2-chloro-3,3,3-trifluoroprop-1-en-1-yl)-2,2-dimethylcyclopropanecarboxylic acid ChEBI
Registry Numbers Types Sources
1969652 Reaxys Registry Number Reaxys
1969652 Beilstein Registry Number Beilstein
74609-46-4 CAS Registry Number ChemIDplus
Last Modified
14 July 2011