N-(2,2,2-trinitroethyl)-N-[2-[tris(difluoroamino)methoxy]ethyl]nitramide

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Basic information

CAS: 69666-94-0
Standard SMILES: O=[N+]([O-])N(CCOC(N(F)F)(N(F)F)N(F)F)CC([N+](=O)[O-])([N+](=O)[O-])[N+](=O)[O-]
InChIKey: XMTUJGQLJPLYAT-UHFFFAOYSA-N
Molecular formula: C5H6F6N8O9
Average molar mass: 436.14 g/mol
Monoisotopic mass: 436.01619277

Names & identifiers

Preferred name: N-(2,2,2-trinitroethyl)-N-[2-[tris(difluoroamino)methoxy]ethyl]nitramide
IUPAC: N-(2,2,2-trinitroethyl)-N-[2-[tris(difluoroamino)methoxy]ethyl]nitramide

Names & synonyms

69666-94-0N-(2,2,2-trinitroethyl)-N-[2-[tris(difluoroamino)methoxy]ethyl]nitramideN-(2,2,2-Trinitroethyl)-N-{2-[tris(difluoroamino)methoxy]ethyl}nitramideNSC309949DTXSID00316996NSC-309949

Database identifiers

CAS: 69666-94-0
PubChem CID: 328973
DTXSID: DTXSID00316996

Properties

Computed structural properties

XLogP: 1
Topological polar surface area: 205 Å²
Hydrogen bond donors: 0
Hydrogen bond acceptors: 19
Rotatable bonds: 6
Heavy atoms: 28
Formal charge: 0
Complexity: 542

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Compound notes

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