3-amino-4-chloro-5-methyl-4-nitrocyclopent-2-ene-1,1,2-tricarbonitrile
Chemical Structure Depiction of
3-amino-4-chloro-5-methyl-4-nitrocyclopent-2-ene-1,1,2-tricarbonitrile
3-amino-4-chloro-5-methyl-4-nitrocyclopent-2-ene-1,1,2-tricarbonitrile
Compound characteristics
| Compound ID: | 8011-1495 |
| Compound Name: | 3-amino-4-chloro-5-methyl-4-nitrocyclopent-2-ene-1,1,2-tricarbonitrile |
| Molecular Weight: | 251.63 |
| Molecular Formula: | C9 H6 Cl N5 O2 |
| Smiles: | CC1C(C#N)(C#N)C(C#N)=C(C1([N+]([O-])=O)[Cl])N |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 0.8026 |
| logD: | 0.8026 |
| logSw: | -1.6242 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 103.843 |
| InChI Key: | CWRGCDKIXIGGAV-UHFFFAOYSA-N |