hexadecyl 9-(dicyanomethylidene)-2,7-dinitro-9H-fluorene-4-carboxylate
Chemical Structure Depiction of
hexadecyl 9-(dicyanomethylidene)-2,7-dinitro-9H-fluorene-4-carboxylate
hexadecyl 9-(dicyanomethylidene)-2,7-dinitro-9H-fluorene-4-carboxylate
Compound characteristics
| Compound ID: | 1509-0018 |
| Compound Name: | hexadecyl 9-(dicyanomethylidene)-2,7-dinitro-9H-fluorene-4-carboxylate |
| Molecular Weight: | 586.69 |
| Molecular Formula: | C33 H38 N4 O6 |
| Smiles: | CCCCCCCCCCCCCCCCOC(c1cc(cc2C(=C(C#N)C#N)c3cc(ccc3c12)[N+]([O-])=O)[N+]([O-])=O)=O |
| Stereo: | ACHIRAL |
| logP: | 10.5946 |
| logD: | 10.5946 |
| logSw: | -5.883 |
| Hydrogen bond acceptors count: | 13 |
| Polar surface area: | 122.177 |
| InChI Key: | KCYGVYYYWFXTEK-UHFFFAOYSA-N |