Vitas-M small molecule compound
methyl 2-methyl-3,5-dinitrobenzoate
Catalog ID
STK377453
SMILES 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 C9H8N2O6 MW 240.17 g/mol Purity >90% as per NMR
InChI
InChI=1S/C9H8N2O6/c1-5-7(9(12)17-2)3-6(10(13)14)4-8(5)11(15)16/h3-4H,1-2H3InChIKey
ISOMVMHVOAAAJX-UHFFFAOYSA-NSynonyms
52090-24-12METHYL35DINITROBENZOICACIDMETHYLESTER
52090241
BENZOICACID2METHYL35DINITROMETHYLESTER
CC1=C(C=C(C=C1C(=O)OC)(N+)(=O)(O))(N+)(=O)(O)
COC(=O)c1cc(cc(c1C)(N+)(=O)(O))(N+)(=O)(O)
InChI=1SC9H8N2O6c157(9(12)172)36(10(13)14)48(5)11(15)16h34H12H3
methyl2methyl35dinitrobenzoate
METHYL35DINITROORTHOTOLUATE
MFCD00229501
ZINC000003132411
ZINC03132411
ZINC3132411
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Check stock on Vitas-MAvailable files
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