1,1'-(3,4,4-trichloro-2-nitrobuta-1,3-diene-1,1-diyl)bis(azepane)
Chemical Structure Depiction of
1,1'-(3,4,4-trichloro-2-nitrobuta-1,3-diene-1,1-diyl)bis(azepane)
1,1'-(3,4,4-trichloro-2-nitrobuta-1,3-diene-1,1-diyl)bis(azepane)
Compound characteristics
| Compound ID: | 4872-0732 |
| Compound Name: | 1,1'-(3,4,4-trichloro-2-nitrobuta-1,3-diene-1,1-diyl)bis(azepane) |
| Molecular Weight: | 396.74 |
| Molecular Formula: | C16 H24 Cl3 N3 O2 |
| Smiles: | C1CCCN(CC1)C(=C(C(=C([Cl])[Cl])[Cl])[N+]([O-])=O)N1CCCCCC1 |
| Stereo: | ACHIRAL |
| logP: | 5.9258 |
| logD: | 5.9258 |
| logSw: | -6.0874 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 37.616 |
| InChI Key: | RFWFTUHMWWNOKI-UHFFFAOYSA-N |