Molecule ID: 6919876

IUPAC Name: (1S,3R)-3-(2,2-dichloroethenyl)-2,2-dimethylcyclopropane-1-carboxylate

Description: The molecule is the 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. It is a conjugate base of a (1S,3R)-3-(2,2-dichlorovinyl)-2,2-dimethylcyclopropanecarboxylic acid.

SMILES: CC1(C)[C@@H](C=C(Cl)Cl)[C@@H]1C(=O)[O-]

SELFIES: [C][C][Branch1][C][C][C@@H1][Branch1][#Branch1][C][=C][Branch1][C][Cl][Cl][C@@H1][Ring1][Branch2][C][=Branch1][C][=O][O-1]

InChI: InChI=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

Molecular Properties:
- Polar Surface Area: 40.1 Ų
- LogP: 4.0