3-(2,3-dihydro-1,4-benzodioxin-6-yl)-4-oxo-6-propyl-4H-1-benzopyran-7-yl acetate
Chemical Structure Depiction of
3-(2,3-dihydro-1,4-benzodioxin-6-yl)-4-oxo-6-propyl-4H-1-benzopyran-7-yl acetate
3-(2,3-dihydro-1,4-benzodioxin-6-yl)-4-oxo-6-propyl-4H-1-benzopyran-7-yl acetate
Compound characteristics
| Compound ID: | 2188-3844 |
| Compound Name: | 3-(2,3-dihydro-1,4-benzodioxin-6-yl)-4-oxo-6-propyl-4H-1-benzopyran-7-yl acetate |
| Molecular Weight: | 380.4 |
| Molecular Formula: | C22 H20 O6 |
| Smiles: | CCCc1cc2C(C(=COc2cc1OC(C)=O)c1ccc2c(c1)OCCO2)=O |
| Stereo: | ACHIRAL |
| logP: | 3.4086 |
| logD: | 3.4086 |
| logSw: | -3.6101 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 57.521 |
| InChI Key: | SRSYXQPCSHXPDQ-UHFFFAOYSA-N |