methyl 2-[(6-chloro-2-oxo-4-phenyl-2H-1-benzopyran-7-yl)oxy]propanoate
Chemical Structure Depiction of
methyl 2-[(6-chloro-2-oxo-4-phenyl-2H-1-benzopyran-7-yl)oxy]propanoate
methyl 2-[(6-chloro-2-oxo-4-phenyl-2H-1-benzopyran-7-yl)oxy]propanoate
Compound characteristics
| Compound ID: | Y040-0312 |
| Compound Name: | methyl 2-[(6-chloro-2-oxo-4-phenyl-2H-1-benzopyran-7-yl)oxy]propanoate |
| Molecular Weight: | 358.78 |
| Molecular Formula: | C19 H15 Cl O5 |
| Smiles: | CC(C(=O)OC)Oc1cc2c(cc1[Cl])C(=CC(=O)O2)c1ccccc1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.0658 |
| logD: | 4.0658 |
| logSw: | -4.5387 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 48.424 |
| InChI Key: | HBXUYYTZFKKTJX-NSHDSACASA-N |