dimethyl 2-benzoyl-2-ethyl-3-(4-nitrophenyl)cyclopropane-1,1-dicarboxylate
Chemical Structure Depiction of
dimethyl 2-benzoyl-2-ethyl-3-(4-nitrophenyl)cyclopropane-1,1-dicarboxylate
dimethyl 2-benzoyl-2-ethyl-3-(4-nitrophenyl)cyclopropane-1,1-dicarboxylate
Compound characteristics
| Compound ID: | 8011-5354 |
| Compound Name: | dimethyl 2-benzoyl-2-ethyl-3-(4-nitrophenyl)cyclopropane-1,1-dicarboxylate |
| Molecular Weight: | 411.41 |
| Molecular Formula: | C22 H21 N O7 |
| Smiles: | CCC1(C(c2ccc(cc2)[N+]([O-])=O)C1(C(=O)OC)C(=O)OC)C(c1ccccc1)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 4.3663 |
| logD: | 4.3663 |
| logSw: | -4.3267 |
| Hydrogen bond acceptors count: | 12 |
| Polar surface area: | 89.686 |
| InChI Key: | IZPUYYLMWMIFCM-UHFFFAOYSA-N |