3-(7,8-dimethoxy-4-methyl-2-oxo-2H-1-benzopyran-3-yl)propanoic acid
Chemical Structure Depiction of
3-(7,8-dimethoxy-4-methyl-2-oxo-2H-1-benzopyran-3-yl)propanoic acid
3-(7,8-dimethoxy-4-methyl-2-oxo-2H-1-benzopyran-3-yl)propanoic acid
Compound characteristics
| Compound ID: | D715-2544 |
| Compound Name: | 3-(7,8-dimethoxy-4-methyl-2-oxo-2H-1-benzopyran-3-yl)propanoic acid |
| Molecular Weight: | 292.29 |
| Molecular Formula: | C15 H16 O6 |
| Smiles: | CC1=C(CCC(O)=O)C(=O)Oc2c1ccc(c2OC)OC |
| Stereo: | ACHIRAL |
| logP: | 1.8563 |
| logD: | -0.64 |
| logSw: | -2.4548 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 64.576 |
| InChI Key: | NSVIYXGOHRVGIX-UHFFFAOYSA-N |