2,2-dimethyl-5,5-bis[(4-nitrophenyl)methyl]-1,3-dioxane-4,6-dione
Chemical Structure Depiction of
2,2-dimethyl-5,5-bis[(4-nitrophenyl)methyl]-1,3-dioxane-4,6-dione
2,2-dimethyl-5,5-bis[(4-nitrophenyl)methyl]-1,3-dioxane-4,6-dione
Compound characteristics
| Compound ID: | 8006-4664 |
| Compound Name: | 2,2-dimethyl-5,5-bis[(4-nitrophenyl)methyl]-1,3-dioxane-4,6-dione |
| Molecular Weight: | 414.37 |
| Molecular Formula: | C20 H18 N2 O8 |
| Smiles: | CC1(C)OC(C(Cc2ccc(cc2)[N+]([O-])=O)(Cc2ccc(cc2)[N+]([O-])=O)C(=O)O1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.7389 |
| logD: | 3.7389 |
| logSw: | -4.1276 |
| Hydrogen bond acceptors count: | 14 |
| Polar surface area: | 107.936 |
| InChI Key: | VSODMOTYJZXJOB-UHFFFAOYSA-N |