Vitas-M small molecule compound

4-[(E)-2-cyano-2-(3-fluorophenyl)ethenyl]benzonitrile

Catalog ID
STK201609
SMILES N#C/C(=C/c1ccc(cc1)C#N)/c1cccc(c1)F

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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 C16H9FN2 MW 248.26 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H9FN2/c17-16-3-1-2-14(9-16)15(11-19)8-12-4-6-13(10-18)7-5-12/h1-9H/b15-8-
InChIKey
XEOLMSRWMGDKCE-NVNXTCNLSA-N
Synonyms

4((E)2CYANO2(3FLUOROPHENYL)ETHENYL)BENZONITRILE
C1=CC(=CC(=C1)F)C(=CC2=CC=C(C=C2)C#N)C#N
InChI=1SC16H9FN2c171631214(916)15(1119)8124613(1018)7512h19Hb158
MFCD06626865
N#CC(=Cc1ccc(cc1)C#N)c1cccc(c1)F
ZINC000004739841
ZINC04739841
ZINC4739841

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Available files

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