CHEBI:39344 - cis-3-(2,2-dibromovinyl)-2,2-dimethylcyclopropanecarboxylic acid

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ChEBI Name cis-3-(2,2-dibromovinyl)-2,2-dimethylcyclopropanecarboxylic acid
ChEBI ID CHEBI:39344
ChEBI ASCII Name cis-3-(2,2-dibromovinyl)-2,2-dimethylcyclopropanecarboxylic acid
Definition An organobromine compound consisting of cyclopropanecarboxylic acid having a 2,2-dibromovinyl 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
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Formula C8H10Br2O2
Net Charge 0
Average Mass 297.97180
Monoisotopic Mass 295.90476
InChI InChI=1S/C8H10Br2O2/c1-8(2)4(3-5(9)10)6(8)7(11)12/h3-4,6H,1-2H3,(H,11,12)/t4-,6-/m0/s1
InChIKey MDIQXIJPQWLFSD-NJGYIYPDSA-N
SMILES CC1(C)[C@@H](C=C(Br)Br)[C@H]1C(O)=O
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 cis-3-(2,2-dibromovinyl)-2,2-dimethylcyclopropanecarboxylic acid (CHEBI:39344) has functional parent cyclopropanecarboxylic acid (CHEBI:23500)
cis-3-(2,2-dibromovinyl)-2,2-dimethylcyclopropanecarboxylic acid (CHEBI:39344) is a monocarboxylic acid (CHEBI:25384)
cis-3-(2,2-dibromovinyl)-2,2-dimethylcyclopropanecarboxylic acid (CHEBI:39344) is a organobromine compound (CHEBI:37141)
Incoming deltamethrin (CHEBI:4388) has functional parent cis-3-(2,2-dibromovinyl)-2,2-dimethylcyclopropanecarboxylic acid (CHEBI:39344)
IUPAC Name
rel-(1R,3R)-3-(2,2-dibromoethenyl)-2,2-dimethylcyclopropanecarboxylic acid
Synonym Source
cis-3-(2,2-Dibromoethenyl)-2,2-dimethylcyclopropanecarboxylic acid ChemIDplus
Registry Number Type Source
63597-73-9 CAS Registry Number ChemIDplus
Last Modified
18 March 2011
General Comment
2007-08-23 Structure, InChI and SMILES shown are those of the isomer with 1R,3R absolute configuration.