2-hydroxy-3-(1-methyl-3-nitro-5-oxo-1,5-dihydro-4H-1,2,4-triazol-4-yl)propyl nitrate
Chemical Structure Depiction of
2-hydroxy-3-(1-methyl-3-nitro-5-oxo-1,5-dihydro-4H-1,2,4-triazol-4-yl)propyl nitrate
2-hydroxy-3-(1-methyl-3-nitro-5-oxo-1,5-dihydro-4H-1,2,4-triazol-4-yl)propyl nitrate
Compound characteristics
| Compound ID: | 8005-3492 |
| Compound Name: | 2-hydroxy-3-(1-methyl-3-nitro-5-oxo-1,5-dihydro-4H-1,2,4-triazol-4-yl)propyl nitrate |
| Molecular Weight: | 263.16 |
| Molecular Formula: | C6 H9 N5 O7 |
| Smiles: | CN1C(N(CC(CO[N+]([O-])=O)O)C(=N1)[N+]([O-])=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | -0.008 |
| logD: | -0.008 |
| logSw: | -0.6576 |
| Hydrogen bond acceptors count: | 13 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 128.402 |
| InChI Key: | COFGONPREMUHFP-BYPYZUCNSA-N |