2-(3-chloro-1,3-dinitroprop-2-en-1-ylidene)-1,3-diazinane
Chemical Structure Depiction of
2-(3-chloro-1,3-dinitroprop-2-en-1-ylidene)-1,3-diazinane
2-(3-chloro-1,3-dinitroprop-2-en-1-ylidene)-1,3-diazinane
Compound characteristics
| Compound ID: | 4872-0620 |
| Compound Name: | 2-(3-chloro-1,3-dinitroprop-2-en-1-ylidene)-1,3-diazinane |
| Molecular Weight: | 248.62 |
| Molecular Formula: | C7 H9 Cl N4 O4 |
| Smiles: | C1CNC(=C(/C=C(/[N+]([O-])=O)[Cl])[N+]([O-])=O)NC1 |
| Stereo: | ACHIRAL |
| logP: | 0.417 |
| logD: | 0.417 |
| logSw: | -2.0273 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 86.324 |
| InChI Key: | REZFJCZDPCOFPH-UHFFFAOYSA-N |