1-(4-chlorophenyl)-3-(4,7-dimethoxy-2H-1,3-benzodioxol-5-yl)prop-2-en-1-one
Chemical Structure Depiction of
1-(4-chlorophenyl)-3-(4,7-dimethoxy-2H-1,3-benzodioxol-5-yl)prop-2-en-1-one
1-(4-chlorophenyl)-3-(4,7-dimethoxy-2H-1,3-benzodioxol-5-yl)prop-2-en-1-one
Compound characteristics
| Compound ID: | 8019-7051 |
| Compound Name: | 1-(4-chlorophenyl)-3-(4,7-dimethoxy-2H-1,3-benzodioxol-5-yl)prop-2-en-1-one |
| Molecular Weight: | 346.77 |
| Molecular Formula: | C18 H15 Cl O5 |
| Smiles: | COc1cc(/C=C/C(c2ccc(cc2)[Cl])=O)c(c2c1OCO2)OC |
| Stereo: | ACHIRAL |
| logP: | 3.7658 |
| logD: | 3.7658 |
| logSw: | -4.3279 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 45.045 |
| InChI Key: | MEJFUTDMLQJCIX-UHFFFAOYSA-N |