3-(2-chloro-4,5-difluorophenyl)oxirane-2-carboxylic acid
Chemical Structure Depiction of
3-(2-chloro-4,5-difluorophenyl)oxirane-2-carboxylic acid
3-(2-chloro-4,5-difluorophenyl)oxirane-2-carboxylic acid
Compound characteristics
| Compound ID: | 3094-0017 |
| Compound Name: | 3-(2-chloro-4,5-difluorophenyl)oxirane-2-carboxylic acid |
| Molecular Weight: | 234.58 |
| Molecular Formula: | C9 H5 Cl F2 O3 |
| Smiles: | c1c(C2C(C(O)=O)O2)c(cc(c1F)F)[Cl] |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 2.1729 |
| logD: | -1.0504 |
| logSw: | -2.4514 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 37.099 |
| InChI Key: | IFGYUMKPTJRVMG-UHFFFAOYSA-N |