methyl (3-bromo-1H-1,2,4-triazol-1-yl)acetate
Chemical Structure Depiction of
methyl (3-bromo-1H-1,2,4-triazol-1-yl)acetate
methyl (3-bromo-1H-1,2,4-triazol-1-yl)acetate
Compound characteristics
| Compound ID: | 8020-5793 |
| Compound Name: | methyl (3-bromo-1H-1,2,4-triazol-1-yl)acetate |
| Molecular Weight: | 220.02 |
| Molecular Formula: | C5 H6 Br N3 O2 |
| Smiles: | COC(Cn1cnc(n1)[Br])=O |
| Stereo: | ACHIRAL |
| logP: | 0.2728 |
| logD: | 0.2728 |
| logSw: | -0.7076 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 45.876 |
| InChI Key: | MOHORHHADUWSFQ-UHFFFAOYSA-N |