prop-2-en-1-yl {[6-chloro-3-(2-methoxy-2-oxoethyl)-4-methyl-2-oxo-2H-1-benzopyran-7-yl]oxy}acetate
Chemical Structure Depiction of
prop-2-en-1-yl {[6-chloro-3-(2-methoxy-2-oxoethyl)-4-methyl-2-oxo-2H-1-benzopyran-7-yl]oxy}acetate
prop-2-en-1-yl {[6-chloro-3-(2-methoxy-2-oxoethyl)-4-methyl-2-oxo-2H-1-benzopyran-7-yl]oxy}acetate
Compound characteristics
| Compound ID: | Y040-7953 |
| Compound Name: | prop-2-en-1-yl {[6-chloro-3-(2-methoxy-2-oxoethyl)-4-methyl-2-oxo-2H-1-benzopyran-7-yl]oxy}acetate |
| Molecular Weight: | 380.78 |
| Molecular Formula: | C18 H17 Cl O7 |
| Smiles: | CC1=C(CC(=O)OC)C(=O)Oc2cc(c(cc12)[Cl])OCC(=O)OCC=C |
| Stereo: | ACHIRAL |
| logP: | 3.0276 |
| logD: | 3.0276 |
| logSw: | -3.3772 |
| Hydrogen bond acceptors count: | 10 |
| Polar surface area: | 69.778 |
| InChI Key: | JTHPVYLEKVIOIY-UHFFFAOYSA-N |