5-(1H-tetrazol-1-yl)benzene-1,3-dicarboxylic acid
Chemical Structure Depiction of
5-(1H-tetrazol-1-yl)benzene-1,3-dicarboxylic acid
5-(1H-tetrazol-1-yl)benzene-1,3-dicarboxylic acid
Compound characteristics
| Compound ID: | Y041-3777 |
| Compound Name: | 5-(1H-tetrazol-1-yl)benzene-1,3-dicarboxylic acid |
| Molecular Weight: | 234.17 |
| Molecular Formula: | C9 H6 N4 O4 |
| Smiles: | c1c(cc(cc1C(O)=O)n1cnnn1)C(O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.1767 |
| logD: | -3.4191 |
| logSw: | -1.337 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 96.82 |
| InChI Key: | LTXHNRONGYGYOW-UHFFFAOYSA-N |