1-(3,5-dichloro-1H-1,2,4-triazol-1-yl)propan-2-one
Chemical Structure Depiction of
1-(3,5-dichloro-1H-1,2,4-triazol-1-yl)propan-2-one
1-(3,5-dichloro-1H-1,2,4-triazol-1-yl)propan-2-one
Compound characteristics
| Compound ID: | 8017-4523 |
| Compound Name: | 1-(3,5-dichloro-1H-1,2,4-triazol-1-yl)propan-2-one |
| Molecular Weight: | 194.02 |
| Molecular Formula: | C5 H5 Cl2 N3 O |
| Smiles: | CC(Cn1c(nc(n1)[Cl])[Cl])=O |
| Stereo: | ACHIRAL |
| logP: | 0.5427 |
| logD: | 0.5427 |
| logSw: | -1.565 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 38.584 |
| InChI Key: | GHHPTRPUNZLOGZ-UHFFFAOYSA-N |