2,4,6-Trinitro-1,3,5-triazinane--2-methyl-1,3,5-trinitrobenzene (3/1)
2-methyl-1,3,5-trinitrobenzene;tris(2,4,6-trinitro-1,3,5-triazinane)
Also Known As: B 3 (lubricant)|AC1L1XL5|2,4,6-Trinitro-1,3,5-triazinane--2-methyl-1,3,5-trinitrobenzene (3/1)|2-methyl-1,3,5-trinitrobenzene; 2,4,6-trinitro-1,3,5-triazinane
| Molecular Formula | C16H23N21O24 |
|---|---|
| Molecular Weight | 893.1225 g/mol |
| LogP | -5.93 |
| Topological Polar Surface Area | 625.95 Ų |
| Hydrogen Bond Donors | 9 |
| Hydrogen Bond Acceptors | 33 |
| Rotatable Bonds | 12 |
| Exact Mass | 893.1225 |
| Heavy Atoms | 61 |
| Complexity | 1612.8 |
Chemical Identifiers
| CAS Number | 8065-53-0 |
|---|---|
| SMILES | CC1=C(C=C(C=C1[N+](=O)[O-])[N+](=O)[O-])[N+](=O)[O-].C1(NC(NC(N1)[N+](=O)[O-])[N+](=O)[O-])[N+](=O)[O-].C1(NC(NC(N1)[N+](=O)[O-])[N+](=O)[O-])[N+](=O)[O-].C1(NC(NC(N1)[N+](=O)[O-])[N+](=O)[O-])[N+](=O)[O-] |
Product Overview
2,4,6-Trinitro-1,3,5-triazinane--2-methyl-1,3,5-trinitrobenzene (3/1) (CAS 8065-53-0), with molecular formula C16H23N21O24 and molecular weight 893.1225 g/mol. IUPAC: 2-methyl-1,3,5-trinitrobenzene;tris(2,4,6-trinitro-1,3,5-triazinane).
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