13-nitro-2,3,5,6,8,9-hexahydro-1,4,7,10-benzotetraoxacyclododecin-12-amine
Chemical Structure Depiction of
13-nitro-2,3,5,6,8,9-hexahydro-1,4,7,10-benzotetraoxacyclododecin-12-amine
13-nitro-2,3,5,6,8,9-hexahydro-1,4,7,10-benzotetraoxacyclododecin-12-amine
Compound characteristics
| Compound ID: | 0242-0492 |
| Compound Name: | 13-nitro-2,3,5,6,8,9-hexahydro-1,4,7,10-benzotetraoxacyclododecin-12-amine |
| Molecular Weight: | 284.27 |
| Molecular Formula: | C12 H16 N2 O6 |
| Smiles: | C1COCCOc2cc(c(cc2OCCO1)N)[N+]([O-])=O |
| Stereo: | ACHIRAL |
| logP: | 0.3159 |
| logD: | 0.3159 |
| logSw: | -1.3153 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 85.386 |
| InChI Key: | ILQPHLPWMLXAEH-UHFFFAOYSA-N |