Vitas-M small molecule compound

2-cyano-4-nitrophenyl acetate

Catalog ID
STK397748
SMILES N#Cc1cc(ccc1OC(=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 C9H6N2O4 MW 206.16 g/mol Purity >90% as per NMR
InChI
InChI=1S/C9H6N2O4/c1-6(12)15-9-3-2-8(11(13)14)4-7(9)5-10/h2-4H,1H3
InChIKey
DDTGWYDFGGLCIA-UHFFFAOYSA-N
Synonyms
879181-43-8
(2cyano4nitrophenyl)acetate
2cyano4nitrophenylacetate
879181438
ACETICACID2CYANO4NITROPHENYLESTER
CC(=O)OC1=C(C=C(C=C1)(N+)(=O)(O))C#N
InChI=1SC9H6N2O4c16(12)159328(11(13)14)47(9)510h24H1H3
MFCD07434238
N#Cc1cc(ccc1OC(=O)C)(N+)(=O)(O)
ZINC000100006046
ZINC100006046

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Available files

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