N-[(2H-1,3-benzodioxol-5-yl)methyl]-2,2,2-trichloroacetamide
Chemical Structure Depiction of
N-[(2H-1,3-benzodioxol-5-yl)methyl]-2,2,2-trichloroacetamide
N-[(2H-1,3-benzodioxol-5-yl)methyl]-2,2,2-trichloroacetamide
Compound characteristics
| Compound ID: | Y032-1744 |
| Compound Name: | N-[(2H-1,3-benzodioxol-5-yl)methyl]-2,2,2-trichloroacetamide |
| Molecular Weight: | 296.53 |
| Molecular Formula: | C10 H8 Cl3 N O3 |
| Smiles: | C(c1ccc2c(c1)OCO2)NC(C([Cl])([Cl])[Cl])=O |
| Stereo: | ACHIRAL |
| logP: | 2.733 |
| logD: | 2.7321 |
| logSw: | -3.3772 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 42.039 |
| InChI Key: | IPIMYTZARCNUBD-UHFFFAOYSA-N |