1,3-Dinitro-1,3-diazacycloheptane
1,3-dinitro-1,3-diazepane
Also Known As: 1,3-Dinitro-1,3-diazacycloheptane|1,3-dinitro-1,3-diazepane|1,3-dinirto-1,3-diazacycloheptane|1,3-Dinitrohexahydro-1H-1,3-diazepine|Hexahydro-1,3-dinitro-1H-1,3-diazepine|1H-1,3-Diazepine, hexahydro-1,3-dinitro-|J1.037.773K
CAS: 5754-90-5
| Molecular Formula | C5H10N4O4 |
|---|---|
| Molecular Weight | 190.0702 g/mol |
| LogP | 1.7 |
| Topological Polar Surface Area | 98.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 0 |
| Exact Mass | 190.0702 |
| Monoisotopic Mass | 190.0702 |
| Heavy Atoms | 13 |
| Complexity | 188.0 |
Chemical Identifiers
| CAS Number | 5754-90-5 |
|---|---|
| SMILES | C1CCN(CN(C1)[N+](=O)[O-])[N+](=O)[O-] |
| InChIKey | XFBIFYVTPFYRSQ-UHFFFAOYSA-N |
Product Overview
1,3-Dinitro-1,3-diazacycloheptane (CAS 5754-90-5), with molecular formula C5H10N4O4 and molecular weight 190.0702 g/mol. IUPAC: 1,3-dinitro-1,3-diazepane.
Safety Data Sheet (MSDS / SDS)
View the Laboratory Chemical Safety Summary (LCSS) on PubChem — includes GHS classifications, hazard statements, first aid measures, and handling precautions.
View MSDS →
1,3-Dinitro-1,3-diazacycloheptane is a custom synthesis product. We offer services from milligram to kilogram scale.
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