12-nitro-2,3,5,6,8,9-hexahydro-1,4,7,10-benzotetraoxacyclododecine
Chemical Structure Depiction of
12-nitro-2,3,5,6,8,9-hexahydro-1,4,7,10-benzotetraoxacyclododecine
12-nitro-2,3,5,6,8,9-hexahydro-1,4,7,10-benzotetraoxacyclododecine
Compound characteristics
| Compound ID: | 0177-0043 |
| Compound Name: | 12-nitro-2,3,5,6,8,9-hexahydro-1,4,7,10-benzotetraoxacyclododecine |
| Molecular Weight: | 269.25 |
| Molecular Formula: | C12 H15 N O6 |
| Smiles: | C1COCCOc2cc(ccc2OCCO1)[N+]([O-])=O |
| Stereo: | ACHIRAL |
| logP: | 0.767 |
| logD: | 0.767 |
| logSw: | -1.6891 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 65.591 |
| InChI Key: | UUQRTEFANVWPTD-UHFFFAOYSA-N |