3-(3,4-difluoroanilino)-4-ethoxycyclobut-3-ene-1,2-dione
Chemical Structure Depiction of
3-(3,4-difluoroanilino)-4-ethoxycyclobut-3-ene-1,2-dione
3-(3,4-difluoroanilino)-4-ethoxycyclobut-3-ene-1,2-dione
Compound characteristics
| Compound ID: | G317-0172 |
| Compound Name: | 3-(3,4-difluoroanilino)-4-ethoxycyclobut-3-ene-1,2-dione |
| Molecular Weight: | 253.2 |
| Molecular Formula: | C12 H9 F2 N O3 |
| Smiles: | CCOC1=C(C(C1=O)=O)Nc1ccc(c(c1)F)F |
| Stereo: | ACHIRAL |
| logP: | 2.4192 |
| logD: | 1.1079 |
| logSw: | -2.9573 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 43.607 |
| InChI Key: | RFPSWBBYAJEMCV-UHFFFAOYSA-N |