Vitas-M small molecule compound
4,4'-[hexane-1,6-diylbis(oxy)]bis(3-nitrobenzonitrile)
Catalog ID
STK377505
SMILES N#Cc1ccc(c(c1)[N+](=O)[O-])OCCCCCCOc1ccc(cc1[N+](=O)[O-])C#N
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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 C20H18N4O6 MW 410.39 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H18N4O6/c21-13-15-5-7-19(17(11-15)23(25)26)29-9-3-1-2-4-10-30-20-8-6-16(14-22)12-18(20)24(27)28/h5-8,11-12H,1-4,9-10H2InChIKey
BQPLOAZGSWZEOS-UHFFFAOYSA-NSynonyms
125880-54-8125880548
4((6(4CYANO2NITROPHENOXY)HEXYL)OXY)3NITROBENZONITRILE
4(6(4CYANO2NITROPHENOXY)HEXOXY)3NITROBENZONITRILE
4(6(4CYANO2NITROPHENOXY)HEXYLOXY)3NITROBENZENECARBONITRILE
44(hexane16diylbis(oxy))bis(3nitrobenzonitrile)
BENZONITRILE44(16HEXANEDIYLBIS(OXY))BIS(3NITRO
C1=CC(=C(C=C1C#N)(N+)(=O)(O))OCCCCCCOC2=C(C=C(C=C2)C#N)(N+)(=O)(O)
InChI=1SC20H18N4O6c2113155719(17(1115)23(25)26)29931241030208616(1422)1218(20)24(27)28h581112H14910H2
MFCD01529805
N#Cc1ccc(c(c1)(N+)(=O)(O))OCCCCCCOc1ccc(cc1(N+)(=O)(O))C#N
ZINC000004181921
ZINC04181921
ZINC4181921
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