1-(2-chlorophenyl)-2-(1H-1,2,4-triazol-1-yl)ethan-1-one
Chemical Structure Depiction of
1-(2-chlorophenyl)-2-(1H-1,2,4-triazol-1-yl)ethan-1-one
1-(2-chlorophenyl)-2-(1H-1,2,4-triazol-1-yl)ethan-1-one
Compound characteristics
| Compound ID: | 0278-0021 |
| Compound Name: | 1-(2-chlorophenyl)-2-(1H-1,2,4-triazol-1-yl)ethan-1-one |
| Molecular Weight: | 221.64 |
| Molecular Formula: | C10 H8 Cl N3 O |
| Smiles: | C(C(c1ccccc1[Cl])=O)n1cncn1 |
| Stereo: | ACHIRAL |
| logP: | 1.1223 |
| logD: | 1.1223 |
| logSw: | -2.8043 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 38.462 |
| InChI Key: | JTBDEWHKDWCHEC-UHFFFAOYSA-N |