Vitas-M small molecule compound

4,5-dimethoxy-2-nitrobenzonitrile

Catalog ID
STK741345
SMILES COc1cc([N+](=O)[O-])c(cc1OC)C#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 C9H8N2O4 MW 208.17 g/mol Purity >90% as per NMR
InChI
InChI=1S/C9H8N2O4/c1-14-8-3-6(5-10)7(11(12)13)4-9(8)15-2/h3-4H,1-2H3
InChIKey
NQSQQGDTYKGCOT-UHFFFAOYSA-N
Synonyms
102714-71-6
102714716
1CYANO45DIMETHOXY2NITROBENZENE
2NITRO45DIMETHOXYBENZONITRILE
45DIMETHOXY2NITROBENZENECARBONITRILE
45dimethoxy2nitrobenzonitrile
6NITROVERATRONITRILE
BENZONITRILE45DIMETHOXY2NITRO
COC1=C(C=C(C(=C1)C#N)(N+)(=O)(O))OC
COc1cc((N+)(=O)(O))c(cc1OC)C#N
InChI=1SC9H8N2O4c114836(510)7(11(12)13)49(8)152h34H12H3
MFCD00017564
ZINC000001431720
ZINC01431720
ZINC1431720

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Available files

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