Vitas-M small molecule compound

2-ethoxy-3,5-dinitrobenzamide

Catalog ID
STL255777
SMILES CCOc1c(cc(cc1[N+](=O)[O-])[N+](=O)[O-])C(=O)N

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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 C9H9N3O6 MW 255.19 g/mol Purity >90% as per NMR
InChI
InChI=1S/C9H9N3O6/c1-2-18-8-6(9(10)13)3-5(11(14)15)4-7(8)12(16)17/h3-4H,2H2,1H3,(H2,10,13)
InChIKey
SRCADXNVJFRQNR-UHFFFAOYSA-N
Synonyms

2ethoxy35dinitrobenzamide
CCOC1=C(C=C(C=C1C(=O)N)(N+)(=O)(O))(N+)(=O)(O)
CCOc1c(cc(cc1(N+)(=O)(O))(N+)(=O)(O))C(=O)N
InChI=1SC9H9N3O6c121886(9(10)13)35(11(14)15)47(8)12(16)17h34H2H21H3(H21013)
MFCD00451037
ZINC000003161140
ZINC3161140

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.