Vitas-M small molecule compound
2,2',2''-[(2,4,6-trinitrobenzene-1,3,5-triyl)triimino]triethanol
Catalog ID
STL335613
SMILES OCCNc1c([N+](=O)[O-])c(NCCO)c(c(c1[N+](=O)[O-])NCCO)[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 C12H18N6O9 MW 390.31 g/mol Purity >90% as per NMR
InChI
InChI=1S/C12H18N6O9/c19-4-1-13-7-10(16(22)23)8(14-2-5-20)12(18(26)27)9(15-3-6-21)11(7)17(24)25/h13-15,19-21H,1-6H2InChIKey
BNULYKZFUFELNU-UHFFFAOYSA-NSynonyms
94467-76-22(35BIS(2HYDROXYETHYLAMINO)246TRINITROANILINO)ETHANOL
2(35BIS(2HYDROXYETHYLAMINO)246TRINITROPHENYLAMINO)ETHANOL
222((246trinitrobenzene135triyl)triimino)triethanol
222((246trinitrobenzene135triyl)tris(azanediyl))triethanol
246TRINITRO135TRIS(2HYDROXYETHYLAMINO)BENZENE
94467762
C(CO)NC1=C(C(=C(C(=C1(N+)(=O)(O))NCCO)(N+)(=O)(O))NCCO)(N+)(=O)(O)
ETHANOL222((246TRINITRO135BENZENETRIYL)TRIIMINO)TRIS
InChI=1SC12H18N6O9c194113710(16(22)23)8(142520)12(18(26)27)9(153621)11(7)17(24)25h13151921H16H2
MFCD00604431
OCCNc1c((N+)(=O)(O))c(NCCO)c(c(c1(N+)(=O)(O))NCCO)(N+)(=O)(O)
ZINC000100494886
ZINC100494886
Check stock
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Check stock on Vitas-MAvailable files
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