sodium--1,1-difluoro-4-(4-fluorophenyl)-4-oxobut-2-en-2-olate (1/1)
Chemical Structure Depiction of
sodium--1,1-difluoro-4-(4-fluorophenyl)-4-oxobut-2-en-2-olate (1/1)
sodium--1,1-difluoro-4-(4-fluorophenyl)-4-oxobut-2-en-2-olate (1/1)
Compound characteristics
| Compound ID: | Y503-3082 |
| Compound Name: | sodium--1,1-difluoro-4-(4-fluorophenyl)-4-oxobut-2-en-2-olate (1/1) |
| Molecular Weight: | 238.14 |
| Molecular Formula: | C10 H6 F3 O2 |
| Salt: | Na+ |
| Smiles: | C(=C(/C(F)F)[O-])/C(c1ccc(cc1)F)=O |
| Stereo: | ACHIRAL |
| logP: | 1.724 |
| logD: | 1.724 |
| logSw: | -1.8898 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 29.0467 |
| InChI Key: | CCZPHYNMHWWRLG-WEVVVXLNSA-M |