Vitas-M small molecule compound

2,13-dinitro-6,7,9,10,17,18,20,21-octahydrodibenzo[b,k][1,4,7,10,13,16]hexaoxacyclooctadecine

Catalog ID
STK400716
SMILES [O-][N+](=O)c1ccc2c(c1)OCCOCCOc1c(OCCOCCO2)cc(cc1)[N+](=O)[O-]

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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.

We do not supply quantities above 5 g.

Structure and other identifiers

2D representation rendered from the SMILES, with core physicochemical data.
Formula C20H22N2O10 MW 450.40 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H22N2O10/c23-21(24)15-1-3-17-19(13-15)31-11-7-28-6-10-30-18-4-2-16(22(25)26)14-20(18)32-12-8-27-5-9-29-17/h1-4,13-14H,5-12H2
InChIKey
JLRXOTNWTNNRCW-UHFFFAOYSA-N
Synonyms
32082-45-4
(O)(N+)(=O)c1ccc2c(c1)OCCOCCOc1c(OCCOCCO2)cc(cc1)(N+)(=O)(O)
213dinitro6791017182021octahydrodibenzo(bk)(147101316)hexaoxacyclooctadecine
32082454
33DINITROBENZO18CROWN6
34(4NITRO21PHENYLENEBIS(OXYETHYLENEOXYETHYLENEOXY))1NITROBENZENE
C1COC2=C(C=C(C=C2)(N+)(=O)(O))OCCOCCOC3=C(C=C(C=C3)(N+)(=O)(O))OCCO1
InChI=1SC20H22N2O10c2321(24)15131719(1315)311172861030184216(22(25)26)1420(18)3212827592917h141314H512H2
MFCD00068492
ZINC000004257963
ZINC04257963
ZINC4257963

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Available files

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