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CHEBI:24556 - 1,3,5-trinitro-1,3,5-triazinane

ChEBI IDCHEBI:24556
ChEBI Name1,3,5-trinitro-1,3,5-triazinane
Stars
DefinitionAn N-nitro compound that is 1,3,5-triazinane in which all three of the hydrogens attached to the nitrogens have been replaced by nitro groups. It is widely used in both industrial and military explosives.
Last Modified12 July 2016
DownloadsMolfile
FormulaC3H6N6O6
Net Charge0
Average Mass222.117
Monoisotopic Mass222.03488
SMILESO=[N+]([O-])N1CN([N+](=O)[O-])CN([N+](=O)[O-])C1
InChIInChI=1S/C3H6N6O6/c10-7(11)4-1-5(8(12)13)3-6(2-4)9(14)15/h1-3H2
InChIKeyXTFIVUDBNACUBN-UHFFFAOYSA-N
Wikipedia
Roles Classification
Chemical Role:
explosive  A substance capable of undergoing rapid and highly exothermic decomposition.
ChEBI Ontology
Outgoing Relation(s)
1,3,5-trinitro-1,3,5-triazinane (CHEBI:24556) has role explosive (CHEBI:63490)
1,3,5-trinitro-1,3,5-triazinane (CHEBI:24556) is a N-nitro compound (CHEBI:38780)
1,3,5-trinitro-1,3,5-triazinane (CHEBI:24556) is a 1,3,5-triazinanes (CHEBI:38779)
IUPAC Name 
1,3,5-trinitro-1,3,5-triazinane
Synonyms  Source
CycloniteChemIDplus
HexogenNIST Chemistry WebBook
hexahydro-1,3,5-trinitro-1,3,5-triazineUM-BBD
cyclotrimethylenetrinitramineChemIDplus
RDXChemIDplus
1,3,5-trinitrohexahydro-1,3,5-triazineChemIDplus
Manual XrefsDatabases
c0639UM-BBD
RDXWikipedia
Registry NumbersSources
Gmelin:985564Gmelin
CAS:121-82-4NIST Chemistry WebBook
CAS:121-82-4ChemIDplus
Citations