Vitas-M small molecule compound

3,4-dimethoxy-2-nitrobenzoic acid

Catalog ID
STK326786
SMILES COc1ccc(c(c1OC)[N+](=O)[O-])C(=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 C9H9NO6 MW 227.17 g/mol Purity >90% as per NMR
InChI
InChI=1S/C9H9NO6/c1-15-6-4-3-5(9(11)12)7(10(13)14)8(6)16-2/h3-4H,1-2H3,(H,11,12)
InChIKey
QZYYEGRMWJAHBY-UHFFFAOYSA-N
Synonyms
79025-28-8
34dimethoxy2nitrobenzoicacid
79025288
COC1=C(C(=C(C=C1)C(=O)O)(N+)(=O)(O))OC
COc1ccc(c(c1OC)(N+)(=O)(O))C(=O)O
InChI=1SC9H9NO6c1156435(9(11)12)7(10(13)14)8(6)162h34H12H3(H1112)
MFCD00074884
ZINC000001062453
ZINC1062453

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Available files

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