3-(7-methoxy-4,8-dimethyl-2-oxo-2H-1-benzopyran-3-yl)propanoic acid
Chemical Structure Depiction of
3-(7-methoxy-4,8-dimethyl-2-oxo-2H-1-benzopyran-3-yl)propanoic acid
3-(7-methoxy-4,8-dimethyl-2-oxo-2H-1-benzopyran-3-yl)propanoic acid
Compound characteristics
| Compound ID: | Y043-5982 |
| Compound Name: | 3-(7-methoxy-4,8-dimethyl-2-oxo-2H-1-benzopyran-3-yl)propanoic acid |
| Molecular Weight: | 276.29 |
| Molecular Formula: | C15 H16 O5 |
| Smiles: | CC1=C(CCC(O)=O)C(=O)Oc2c1ccc(c2C)OC |
| Stereo: | ACHIRAL |
| logP: | 2.4394 |
| logD: | -0.0568 |
| logSw: | -2.6871 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 56.859 |
| InChI Key: | HBQUXVLMABKFQJ-UHFFFAOYSA-N |