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CHEBI:62531 - (1S,3R)-3-(2,2-dichlorovinyl)-2,2-dimethylcyclopropanecarboxylate

ChEBI IDCHEBI:62531
ChEBI Name(1S,3R)-3-(2,2-dichlorovinyl)-2,2-dimethylcyclopropanecarboxylate
Stars
ASCII Name(1S,3R)-3-(2,2-dichlorovinyl)-2,2-dimethylcyclopropanecarboxylate
DefinitionThe monocarboxylic acid anion formed by loss of a proton from the carboxy group of (1S,3R)-3-(2,2-dichlorovinyl)-2,2-dimethylcyclopropanecarboxylic acid; major microspecies at pH 7.3.
Last Modified2 August 2011
SubmitterMarcus Ennis
DownloadsMolfile
FormulaC8H9Cl2O2
Net Charge-1
Average Mass208.064
Monoisotopic Mass206.99851
SMILESCC1(C)[C@@H](C=C(Cl)Cl)[C@@H]1C(=O)[O-]
InChIInChI=1S/C8H10Cl2O2/c1-8(2)4(3-5(9)10)6(8)7(11)12/h3-4,6H,1-2H3,(H,11,12)/p-1/t4-,6+/m0/s1
InChIKeyLLMLSUSAKZVFOA-UJURSFKZSA-M
ChEBI Ontology
Outgoing Relation(s)
(1S,3R)-3-(2,2-dichlorovinyl)-2,2-dimethylcyclopropanecarboxylate (CHEBI:62531) is a monocarboxylic acid anion (CHEBI:35757)
(1S,3R)-3-(2,2-dichlorovinyl)-2,2-dimethylcyclopropanecarboxylate (CHEBI:62531) is conjugate base of (1S,3R)-3-(2,2-dichlorovinyl)-2,2-dimethylcyclopropanecarboxylic acid (CHEBI:62528)
Incoming Relation(s)
(1S,3R)-3-(2,2-dichlorovinyl)-2,2-dimethylcyclopropanecarboxylic acid (CHEBI:62528) is conjugate acid of (1S,3R)-3-(2,2-dichlorovinyl)-2,2-dimethylcyclopropanecarboxylate (CHEBI:62531)
IUPAC Name 
(1S,3R)-3-(2,2-dichloroethenyl)-2,2-dimethylcyclopropanecarboxylate
UniProt Name  Source
(1S,3R)-3-(2,2-dichlorovinyl)-2,2-dimethylcyclopropanecarboxylateUniProt
Manual XrefsDatabases
CPD-13114MetaCyc
Citations