8-formyl-2H,4H-1,3-benzodioxine-6-carboxylic acid
Chemical Structure Depiction of
8-formyl-2H,4H-1,3-benzodioxine-6-carboxylic acid
8-formyl-2H,4H-1,3-benzodioxine-6-carboxylic acid
Compound characteristics
| Compound ID: | 2188-3254 |
| Compound Name: | 8-formyl-2H,4H-1,3-benzodioxine-6-carboxylic acid |
| Molecular Weight: | 208.17 |
| Molecular Formula: | C10 H8 O5 |
| Smiles: | C1c2cc(cc(C=O)c2OCO1)C(O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.4698 |
| logD: | -1.4292 |
| logSw: | -1.5122 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 59.695 |
| InChI Key: | KEBABRDEGSDAMC-UHFFFAOYSA-N |