2-(1H-tetrazol-1-yl)benzene-1,4-dicarboxylic acid
Chemical Structure Depiction of
2-(1H-tetrazol-1-yl)benzene-1,4-dicarboxylic acid
2-(1H-tetrazol-1-yl)benzene-1,4-dicarboxylic acid
Compound characteristics
| Compound ID: | Y041-3754 |
| Compound Name: | 2-(1H-tetrazol-1-yl)benzene-1,4-dicarboxylic acid |
| Molecular Weight: | 234.17 |
| Molecular Formula: | C9 H6 N4 O4 |
| Smiles: | c1cc(C(O)=O)c(cc1C(O)=O)n1cnnn1 |
| Stereo: | ACHIRAL |
| logP: | 1.1572 |
| logD: | -3.1775 |
| logSw: | -2.1382 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 96.519 |
| InChI Key: | NCIYPDVJXCHPCG-UHFFFAOYSA-N |