2-cyclohexyl-1,4-phenylene bis(3-nitrobenzoate)
Chemical Structure Depiction of
2-cyclohexyl-1,4-phenylene bis(3-nitrobenzoate)
2-cyclohexyl-1,4-phenylene bis(3-nitrobenzoate)
Compound characteristics
| Compound ID: | 0917-0141 |
| Compound Name: | 2-cyclohexyl-1,4-phenylene bis(3-nitrobenzoate) |
| Molecular Weight: | 490.47 |
| Molecular Formula: | C26 H22 N2 O8 |
| Smiles: | C1CCC(CC1)c1cc(ccc1OC(c1cccc(c1)[N+]([O-])=O)=O)OC(c1cccc(c1)[N+]([O-])=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.9577 |
| logD: | 5.9577 |
| logSw: | -5.9113 |
| Hydrogen bond acceptors count: | 14 |
| Polar surface area: | 107.764 |
| InChI Key: | KGINBHROJYSFGL-UHFFFAOYSA-N |