2,4,6,8-Tetranitro-2,4,6,8-tetraazanonane-1,9-diyl dinitrate
Basic information
- CAS
13979-94-7- Standard SMILES
O=[N+]([O-])OCN(CN(CN(CN(CO[N+](=O)[O-])[N+](=O)[O-])[N+](=O)[O-])[N+](=O)[O-])[N+](=O)[O-]- InChIKey
JIFNBGMOBAYSNR-UHFFFAOYSA-N- Molecular formula
- C5H10N10O14
- Average molar mass
- 434.19 g/mol
- Monoisotopic mass
- 434.03779503
Names & identifiers
- Preferred name
- 2,4,6,8-Tetranitro-2,4,6,8-tetraazanonane-1,9-diyl dinitrate
- IUPAC
- [nitro-[[nitro-[[nitro-[[nitro(nitrooxymethyl)amino]methyl]amino]methyl]amino]methyl]amino]methyl nitrate
- English name
- 2,4,6,8-tetranitro-2,4,6,8-tetraazanonane-1,9-diyl dinitrate
- Molecular formula
- C5H10N10O14
- Molecular weight
- 434.1915
Names & synonyms
13979-94-72,4,6,8-Tetranitro-2,4,6,8-tetraazanonane-1,9-diyl dinitrateJIFNBGMOBAYSNR-UHFFFAOYSA-NEINECS 237-764-1[nitro-[[nitro-[[nitro-[[nitro(nitrooxymethyl)amino]methyl]amino]methyl]amino]methyl]amino]methyl nitrateSCHEMBL11244779DTXSID80161168NS000245152,4,6,8-Tetranitro-2,4,6,8-tetraazanonane-1,9-diol dinitrate
Database identifiers
- CAS
13979-94-7- PubChem CID
- 84128
- DTXSID
DTXSID80161168- EC Number
- 237-764-1
- Nikkaji
- J216.801D
Properties
Computed structural properties
- XLogP
- 2.9
- Topological polar surface area
- 306 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 18
- Rotatable bonds
- 10
- Heavy atoms
- 29
- Formal charge
- 0
- Complexity
- 568
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Related reactions
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Compound notes
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