Vitas-M small molecule compound
2,2,2-trifluoroethyl 3,5-dinitrobenzoate
Catalog ID
STK371243
SMILES O=C(c1cc(cc(c1)[N+](=O)[O-])[N+](=O)[O-])OCC(F)(F)F
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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 C9H5F3N2O6 MW 294.14 g/mol Purity >90% as per NMR
InChI
InChI=1S/C9H5F3N2O6/c10-9(11,12)4-20-8(15)5-1-6(13(16)17)3-7(2-5)14(18)19/h1-3H,4H2InChIKey
AHFSVZKGXLGRBO-UHFFFAOYSA-NSynonyms
350-18-5222trifluoroethyl35dinitrobenzoate
350185
C1=C(C=C(C=C1(N+)(=O)(O))(N+)(=O)(O))C(=O)OCC(F)(F)F
ETHANOL222TRIFLUORO35DINITROBENZOATE
InChI=1SC9H5F3N2O6c109(1112)4208(15)516(13(16)17)37(25)14(18)19h13H4H2
MFCD00424705
O=C(c1cc(cc(c1)(N+)(=O)(O))(N+)(=O)(O))OCC(F)(F)F
ZINC000001719095
ZINC01719095
ZINC1719095
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