Vitas-M small molecule compound
1-(4,7-dimethoxy-1,3-benzodioxol-5-yl)-2-nitroethanone
Catalog ID
STL434068
SMILES COc1c(cc(c2c1OCO2)OC)C(=O)C[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 C11H11NO7 MW 269.21 g/mol Purity >90% as per NMR
InChI
InChI=1S/C11H11NO7/c1-16-8-3-6(7(13)4-12(14)15)9(17-2)11-10(8)18-5-19-11/h3H,4-5H2,1-2H3InChIKey
ARYMXMCYHFKBER-UHFFFAOYSA-NSynonyms
1(47dimethoxy13benzodioxol5yl)2nitroethanone
COC1=C2C(=C(C(=C1)C(=O)C(N+)(=O)(O))OC)OCO2
COc1c(cc(c2c1OCO2)OC)C(=O)C(N+)(=O)(O)
InChI=1SC11H11NO7c116836(7(13)412(14)15)9(172)1110(8)1851911h3H45H212H3
MFCD24540273
ZINC000100023624
ZINC100023624
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