methyl 2-{[3-(2-methoxy-2-oxoethyl)-4,8-dimethyl-2-oxo-2H-1-benzopyran-7-yl]oxy}propanoate
Chemical Structure Depiction of
methyl 2-{[3-(2-methoxy-2-oxoethyl)-4,8-dimethyl-2-oxo-2H-1-benzopyran-7-yl]oxy}propanoate
methyl 2-{[3-(2-methoxy-2-oxoethyl)-4,8-dimethyl-2-oxo-2H-1-benzopyran-7-yl]oxy}propanoate
Compound characteristics
| Compound ID: | Y040-8208 |
| Compound Name: | methyl 2-{[3-(2-methoxy-2-oxoethyl)-4,8-dimethyl-2-oxo-2H-1-benzopyran-7-yl]oxy}propanoate |
| Molecular Weight: | 348.35 |
| Molecular Formula: | C18 H20 O7 |
| Smiles: | CC(C(=O)OC)Oc1ccc2C(C)=C(CC(=O)OC)C(=O)Oc2c1C |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.6431 |
| logD: | 2.6431 |
| logSw: | -2.9674 |
| Hydrogen bond acceptors count: | 10 |
| Polar surface area: | 69.473 |
| InChI Key: | KVXGSRHLAADWJU-NSHDSACASA-N |