methyl [2-(2,4-dichlorophenyl)-5,5-dimethyl-4,6-dioxooxan-3-yl]acetate
Chemical Structure Depiction of
methyl [2-(2,4-dichlorophenyl)-5,5-dimethyl-4,6-dioxooxan-3-yl]acetate
methyl [2-(2,4-dichlorophenyl)-5,5-dimethyl-4,6-dioxooxan-3-yl]acetate
Compound characteristics
Compound ID: | 8018-1001 |
Compound Name: | methyl [2-(2,4-dichlorophenyl)-5,5-dimethyl-4,6-dioxooxan-3-yl]acetate |
Molecular Weight: | 359.2 |
Molecular Formula: | C16 H16 Cl2 O5 |
Smiles: | CC1(C)C(C(CC(=O)OC)C(c2ccc(cc2[Cl])[Cl])OC1=O)=O |
Stereo: | MIXTURE OF STEREOISOMERS |
logP: | 3.5219 |
logD: | 3.5219 |
logSw: | -3.5724 |
Hydrogen bond acceptors count: | 8 |
Polar surface area: | 55.404 |
InChI Key: | XPQVSXVGVAMAKH-UHFFFAOYSA-N |