ethyl 2-chloro-5-{5-[(2,2-dimethyl-4,6-dioxo-1,3-dioxan-5-ylidene)methyl]furan-2-yl}benzoate
Chemical Structure Depiction of
ethyl 2-chloro-5-{5-[(2,2-dimethyl-4,6-dioxo-1,3-dioxan-5-ylidene)methyl]furan-2-yl}benzoate
ethyl 2-chloro-5-{5-[(2,2-dimethyl-4,6-dioxo-1,3-dioxan-5-ylidene)methyl]furan-2-yl}benzoate
Compound characteristics
| Compound ID: | 4167-0077 |
| Compound Name: | ethyl 2-chloro-5-{5-[(2,2-dimethyl-4,6-dioxo-1,3-dioxan-5-ylidene)methyl]furan-2-yl}benzoate |
| Molecular Weight: | 404.8 |
| Molecular Formula: | C20 H17 Cl O7 |
| Smiles: | CCOC(c1cc(ccc1[Cl])c1ccc(C=C2C(=O)OC(C)(C)OC2=O)o1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.6639 |
| logD: | 4.6639 |
| logSw: | -4.9316 |
| Hydrogen bond acceptors count: | 10 |
| Polar surface area: | 69.768 |
| InChI Key: | VYOGOPCVQQYQEX-UHFFFAOYSA-N |