3-(3-chloro-1H-1,2,4-triazol-5-yl)propanoic acid
Chemical Structure Depiction of
3-(3-chloro-1H-1,2,4-triazol-5-yl)propanoic acid
3-(3-chloro-1H-1,2,4-triazol-5-yl)propanoic acid
Compound characteristics
| Compound ID: | 8020-5807 |
| Compound Name: | 3-(3-chloro-1H-1,2,4-triazol-5-yl)propanoic acid |
| Molecular Weight: | 175.57 |
| Molecular Formula: | C5 H6 Cl N3 O2 |
| Smiles: | C(Cc1nc(n[nH]1)[Cl])C(O)=O |
| Stereo: | ACHIRAL |
| logP: | 0.3539 |
| logD: | -2.4857 |
| logSw: | -1.7446 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 63.403 |
| InChI Key: | UYZDCYGGFIDYCL-UHFFFAOYSA-N |