Chemical Name - 5-Amino-1h-1,2,3,4-Tetrazole (Monohydrate)
Mol Weight - 85.0698
Smiles - Nc1nnn[nH]1.O
Mol Weight - 85.0698
Smiles - Nc1nnn[nH]1.O
| Property Value | |
| Mol Name | 5-Amino-1h-1,2,3,4-Tetrazole (Monohydrate) |
| Molweight | 85.0698 |
| Monoisotopic Mass | 85.038845 |
| Clogp | -1.0248 |
| Clogs | -1.1 |
| H Acceptors | 5 |
| H Donors | 2 |
| Total Surface Area | 67.63 |
| Relative Psa | 0.91927 |
| Polar Surface Area | 80.48 |
| Druglikeness | -0.30218 |
| Mutagenic | none |
| Tumorigenic | none |
| Reproductive Effective | none |
| Irritant | none |
| Shape Index | 0.66667 |
| Molecular Complexity | 0.69315 |
| Fragments | 2 |
| Non H Atoms | 6 |
| Non Ch Atoms | 5 |
| Electronegative Atoms | 5 |
| Rings Closures | 1 |
| Small Rings | 1 |
| Aromatic Rings | 1 |
| Aromatic Atoms | 5 |
| Aromatic Nitrogens | 4 |
| Smiles | Nc1nnn[nH]1.O |
| InChIKey | InChI=1S/CH3N5.H2O/c2-1-3-5-6-4-1;/h(H3,2,3,4,5,6);1H2 |
| InChI | JVSMPWHQUPKRNV-UHFFFAOYSA-N |
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1 - 5-Amino-1h-1,2,3,4-Tetrazole (Monohydrate)
2 - 5-Amino-1h-1,2,3,4-Tetrazole (Monohydrate)
1 - 5-Amino-1h-1,2,3,4-Tetrazole (Monohydrate)
2 - 5-Amino-1h-1,2,3,4-Tetrazole (Monohydrate)
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