2-(3-bromo-1H-1,2,4-triazol-1-yl)propanoic acid
Chemical Structure Depiction of
2-(3-bromo-1H-1,2,4-triazol-1-yl)propanoic acid
2-(3-bromo-1H-1,2,4-triazol-1-yl)propanoic acid
Compound characteristics
| Compound ID: | Y507-1091 |
| Compound Name: | 2-(3-bromo-1H-1,2,4-triazol-1-yl)propanoic acid |
| Molecular Weight: | 220.02 |
| Molecular Formula: | C5 H6 Br N3 O2 |
| Smiles: | CC(C(O)=O)n1cnc(n1)[Br] |
| Stereo: | RACEMIC MIXTURE |
| logP: | -0.1493 |
| logD: | -3.4653 |
| logSw: | -0.5606 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 53.51 |
| InChI Key: | RWNNQUUYBYDIHO-VKHMYHEASA-N |