Vitas-M small molecule compound

{4-[(2-methylbenzyl)oxy]benzylidene}propanedinitrile

Catalog ID
STK085155
SMILES N#CC(=Cc1ccc(cc1)OCc1ccccc1C)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 C18H14N2O MW 274.32 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H14N2O/c1-14-4-2-3-5-17(14)13-21-18-8-6-15(7-9-18)10-16(11-19)12-20/h2-10H,13H2,1H3
InChIKey
WHPOLUVMIMROSI-UHFFFAOYSA-N
Synonyms
724780-84-1
(4((2METHYLBENZYL)OXY)BENZYLIDENE)PROPANEDINITRILE
2((4((2METHYLPHENYL)METHOXY)PHENYL)METHYLIDENE)PROPANEDINITRILE
724780841
CC1=CC=CC=C1COC2=CC=C(C=C2)C=C(C#N)C#N
InChI=1SC18H14N2Oc114423517(14)1321188615(7918)1016(1119)1220h210H13H21H3
MFCD04242426
N#CC(=Cc1ccc(cc1)OCc1ccccc1C)C#N
STK085155
ZINC000004672673
ZINC04672673
ZINC4672673

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Available files

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