chempirical

(1R,3S)-3-(2,2-Dichloroethenyl)-2,2-dimethylcyclopropanecarboxylic acid

C8H10Cl2O2CAS 55701-03-6209.07 g/mol

Open in Covalent MOL file
ClClOOH
AlkeneCarboxylic acidVinyl halide

Properties

Molecular formula
C8H10Cl2O2
Molar mass
209.07 g/mol
Exact mass
208.0058 Da
Melting point
70–71 °C
logP
2.66Crippen estimate
Polar surface area
37.3 Ų
H-bond donors / acceptors
1 / 1
Rotatable bonds
2
Stereocentres
S, Rin SMILES atom order

Identifiers

CAS number
55701-03-6
SMILES
CC1(C)[C@H](C=C(Cl)Cl)[C@H]1C(=O)O
InChIKey
LLMLSUSAKZVFOA-XINAWCOVSA-N
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)/t4-,6+/m1/s1

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Type any one amount. The others follow from the molar mass.

Names and synonyms

7 names
  • Cyclopropanecarboxylic acid, 3-(2,2-dichloroethenyl)-2,2-dimethyl-, (1R,3S)-
  • Cyclopropanecarboxylic acid, 3-(2,2-dichloroethenyl)-2,2-dimethyl-, (1R-trans)-
  • 1R-trans-Permethric acid
  • 1R-trans-Permethrinic acid
  • (1R)-(+)-trans-Permethrinic acid
  • (1R)-trans-3-(2,2-Dichloroethenyl)-2,2-dimethylcyclopropanecarboxylic acid
  • (1R)-trans-3-(2,2-Dichloro-1-ethenyl)-2,2-dimethylcyclopropanecarboxylic acid

Work with (1R,3S)-3-(2,2-Dichloroethenyl)-2,2-dimethylcyclopropanecarboxylic acid

Predict the NMR spectrum1H and 13C shifts with multiplicities Make a solutionWhat to weigh for any molarity and volume Check drug-likenessLipinski, Veber and lead-likeness Isotope patternExact mass and the mass spectrum pattern

Same formula

Permethric acid55701-05-8

Elsewhere

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