3-(dimethylamino)-N,N-dimethyl-2-(3-nitro-1H-1,2,4-triazol-1-yl)prop-2-en-1-iminium--perchlorate (1/1)
Chemical Structure Depiction of
3-(dimethylamino)-N,N-dimethyl-2-(3-nitro-1H-1,2,4-triazol-1-yl)prop-2-en-1-iminium--perchlorate (1/1)
3-(dimethylamino)-N,N-dimethyl-2-(3-nitro-1H-1,2,4-triazol-1-yl)prop-2-en-1-iminium--perchlorate (1/1)
Compound characteristics
| Compound ID: | 8010-3924 |
| Compound Name: | 3-(dimethylamino)-N,N-dimethyl-2-(3-nitro-1H-1,2,4-triazol-1-yl)prop-2-en-1-iminium--perchlorate (1/1) |
| Molecular Weight: | 338.7 |
| Molecular Formula: | C9 H15 N6 O2 |
| Salt: | ClO4- |
| Smiles: | CN(C)/C=C(/C=[N+](C)C)n1cnc(n1)[N+]([O-])=O |
| Stereo: | ACHIRAL |
| logP: | -0.237 |
| logD: | -1.6449 |
| logSw: | -0.7815 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 70.709 |
| InChI Key: | SYQFDVXJCKHGLJ-UHFFFAOYSA-N |