methyl {4-methyl-2-oxo-7-[(2-oxocyclohexyl)oxy]-2H-1-benzopyran-3-yl}acetate
Chemical Structure Depiction of
methyl {4-methyl-2-oxo-7-[(2-oxocyclohexyl)oxy]-2H-1-benzopyran-3-yl}acetate
methyl {4-methyl-2-oxo-7-[(2-oxocyclohexyl)oxy]-2H-1-benzopyran-3-yl}acetate
Compound characteristics
| Compound ID: | Y040-2603 |
| Compound Name: | methyl {4-methyl-2-oxo-7-[(2-oxocyclohexyl)oxy]-2H-1-benzopyran-3-yl}acetate |
| Molecular Weight: | 344.36 |
| Molecular Formula: | C19 H20 O6 |
| Smiles: | CC1=C(CC(=O)OC)C(=O)Oc2cc(ccc12)OC1CCCCC1=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.2646 |
| logD: | 2.2646 |
| logSw: | -2.816 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 61.384 |
| InChI Key: | JCVYJCPYWIJUIX-INIZCTEOSA-N |