Vitas-M small molecule compound
2-(3,4-dichlorophenyl)-2-oxoethyl 2-methyl-3,5-dinitrobenzoate
Catalog ID
STK388638
SMILES O=C(c1ccc(c(c1)Cl)Cl)COC(=O)c1cc(cc(c1C)[N+](=O)[O-])[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 C16H10Cl2N2O7 MW 413.17 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H10Cl2N2O7/c1-8-11(5-10(19(23)24)6-14(8)20(25)26)16(22)27-7-15(21)9-2-3-12(17)13(18)4-9/h2-6H,7H2,1H3InChIKey
CISYKFYBTAUZNM-UHFFFAOYSA-NSynonyms
354990-18-4(2(34DICHLOROPHENYL)2OXOETHYL)2METHYL35DINITROBENZOATE
2(34dichlorophenyl)2oxoethyl2methyl35dinitrobenzoate
354990184
CC1=C(C=C(C=C1C(=O)OCC(=O)C2=CC(=C(C=C2)Cl)Cl)(N+)(=O)(O))(N+)(=O)(O)
InChI=1SC16H10Cl2N2O7c1811(510(19(23)24)614(8)20(25)26)16(22)27715(21)92312(17)13(18)49h26H7H21H3
MFCD00502403
O=C(c1ccc(c(c1)Cl)Cl)COC(=O)c1cc(cc(c1C)(N+)(=O)(O))(N+)(=O)(O)
ZINC000001311250
ZINC01311250
ZINC1311250
Check stock
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Check stock on Vitas-MAvailable files
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