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CHEBI:77327 - CL-20

ChEBI IDCHEBI:77327
ChEBI NameCL-20
Stars
DefinitionA polycyclic cage that is hexaazaisowurtzitane in which all six amino hydrogens are replaced by nitro groups.
Last Modified17 February 2014
SubmitterSteve
DownloadsMolfile
FormulaC6H6N12O12
Net Charge0
Average Mass438.186
Monoisotopic Mass438.02281
SMILESO=[N+]([O-])N1C2C3N([N+](=O)[O-])C1C1N([N+](=O)[O-])C(C(N1[N+](=O)[O-])N3[N+](=O)[O-])N2[N+](=O)[O-]
InChIInChI=1S/C6H6N12O12/c19-13(20)7-1-2-8(14(21)22)5(7)6-9(15(23)24)3(11(1)17(27)28)4(10(6)16(25)26)12(2)18(29)30/h1-6H
InChIKeyNDYLCHGXSQOGMS-UHFFFAOYSA-N
Wikipedia
Roles Classification
Chemical Role:
explosive  A substance capable of undergoing rapid and highly exothermic decomposition.
ChEBI Ontology
Outgoing Relation(s)
CL-20 (CHEBI:77327) has role explosive (CHEBI:63490)
CL-20 (CHEBI:77327) is a N-nitro compound (CHEBI:38780)
CL-20 (CHEBI:77327) is a polycyclic cage (CHEBI:33640)
IUPAC Name 
1,3,4,7,8,10-hexanitrooctahydro-1H-5,2,6-(epiminomethanetriylimino)imidazo[4,5-b]pyrazine
Synonyms  Source
Octahydro-1,3,4,7,8,10-hexanitro-5,2,6-(iminomethenimino)-1H-imidazo(4,5-b)pyrazineChemIDplus
HexanitrohexaazaisowurtzitaneChemIDplus
HNIWChemIDplus
Manual XrefsDatabases
HexanitrohexaazaisowurtzitaneWikipedia
Registry NumbersSources
Reaxys:4834707Reaxys
CAS:135285-90-4ChemIDplus
Citations