4-nitro-2-(prop-2-yn-1-yl)-2H-1,2,3-triazole
Chemical Structure Depiction of
4-nitro-2-(prop-2-yn-1-yl)-2H-1,2,3-triazole
4-nitro-2-(prop-2-yn-1-yl)-2H-1,2,3-triazole
Compound characteristics
| Compound ID: | 8010-9318 |
| Compound Name: | 4-nitro-2-(prop-2-yn-1-yl)-2H-1,2,3-triazole |
| Molecular Weight: | 152.11 |
| Molecular Formula: | C5 H4 N4 O2 |
| Smiles: | C#CCn1ncc(n1)[N+]([O-])=O |
| Stereo: | ACHIRAL |
| logP: | 0.431 |
| logD: | 0.431 |
| logSw: | -0.5787 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 58.361 |
| InChI Key: | BEWXXSLHSORSGF-UHFFFAOYSA-N |