2,2-dimethyl-5-{[5-(4-nitrophenyl)furan-2-yl]methylidene}-1,3-dioxane-4,6-dione
Chemical Structure Depiction of
2,2-dimethyl-5-{[5-(4-nitrophenyl)furan-2-yl]methylidene}-1,3-dioxane-4,6-dione
2,2-dimethyl-5-{[5-(4-nitrophenyl)furan-2-yl]methylidene}-1,3-dioxane-4,6-dione
Compound characteristics
| Compound ID: | 3178-0156 |
| Compound Name: | 2,2-dimethyl-5-{[5-(4-nitrophenyl)furan-2-yl]methylidene}-1,3-dioxane-4,6-dione |
| Molecular Weight: | 343.29 |
| Molecular Formula: | C17 H13 N O7 |
| Smiles: | CC1(C)OC(C(=Cc2ccc(c3ccc(cc3)[N+]([O-])=O)o2)C(=O)O1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.4879 |
| logD: | 3.4879 |
| logSw: | -3.7759 |
| Hydrogen bond acceptors count: | 11 |
| Polar surface area: | 82.396 |
| InChI Key: | ZXJSUSMCNDMRCW-UHFFFAOYSA-N |