methyl 2-chloro-5-(1H-tetrazol-1-yl)benzoate
Chemical Structure Depiction of
methyl 2-chloro-5-(1H-tetrazol-1-yl)benzoate
methyl 2-chloro-5-(1H-tetrazol-1-yl)benzoate
Compound characteristics
| Compound ID: | 8013-3954 |
| Compound Name: | methyl 2-chloro-5-(1H-tetrazol-1-yl)benzoate |
| Molecular Weight: | 238.63 |
| Molecular Formula: | C9 H7 Cl N4 O2 |
| Smiles: | COC(c1cc(ccc1[Cl])n1cnnn1)=O |
| Stereo: | ACHIRAL |
| logP: | 1.8386 |
| logD: | 1.8386 |
| logSw: | -2.9442 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 61.178 |
| InChI Key: | OXBZNEZECIIASU-UHFFFAOYSA-N |