prop-2-en-1-yl [(3-benzyl-6-chloro-4-methyl-2-oxo-2H-1-benzopyran-7-yl)oxy]acetate
Chemical Structure Depiction of
prop-2-en-1-yl [(3-benzyl-6-chloro-4-methyl-2-oxo-2H-1-benzopyran-7-yl)oxy]acetate
prop-2-en-1-yl [(3-benzyl-6-chloro-4-methyl-2-oxo-2H-1-benzopyran-7-yl)oxy]acetate
Compound characteristics
| Compound ID: | Y040-1998 |
| Compound Name: | prop-2-en-1-yl [(3-benzyl-6-chloro-4-methyl-2-oxo-2H-1-benzopyran-7-yl)oxy]acetate |
| Molecular Weight: | 398.84 |
| Molecular Formula: | C22 H19 Cl O5 |
| Smiles: | CC1=C(Cc2ccccc2)C(=O)Oc2cc(c(cc12)[Cl])OCC(=O)OCC=C |
| Stereo: | ACHIRAL |
| logP: | 4.9641 |
| logD: | 4.9641 |
| logSw: | -5.1252 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 48.927 |
| InChI Key: | HXSVBAGHUJAJMT-UHFFFAOYSA-N |