5-{[(2H-1,3-benzodioxol-5-yl)oxy]methyl}-1H-tetrazole
Chemical Structure Depiction of
5-{[(2H-1,3-benzodioxol-5-yl)oxy]methyl}-1H-tetrazole
5-{[(2H-1,3-benzodioxol-5-yl)oxy]methyl}-1H-tetrazole
Compound characteristics
| Compound ID: | 8017-6374 |
| Compound Name: | 5-{[(2H-1,3-benzodioxol-5-yl)oxy]methyl}-1H-tetrazole |
| Molecular Weight: | 220.18 |
| Molecular Formula: | C9 H8 N4 O3 |
| Smiles: | C(c1nnn[nH]1)Oc1ccc2c(c1)OCO2 |
| Stereo: | ACHIRAL |
| logP: | 0.886 |
| logD: | -1.1688 |
| logSw: | -1.7698 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 75.956 |
| InChI Key: | SOTVTIFQEXXIEM-UHFFFAOYSA-N |