Vitas-M small molecule compound

(2,4,6-trimethylbenzylidene)propanedinitrile

Catalog ID
STK397818
SMILES N#CC(=Cc1c(C)cc(cc1C)C)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 C13H12N2 MW 196.25 g/mol Purity >90% as per NMR
InChI
InChI=1S/C13H12N2/c1-9-4-10(2)13(11(3)5-9)6-12(7-14)8-15/h4-6H,1-3H3
InChIKey
QOSQQUHFZLHOBR-UHFFFAOYSA-N
Synonyms
15728-35-5
((246TRIMETHYLPHENYL)METHYLENE)METHANE11DICARBONITRILE
(246trimethylbenzylidene)propanedinitrile
(MESITYLMETHYLENE)MALONONITRILE
15728355
2((246TRIMETHYLPHENYL)METHYLIDENE)PROPANEDINITRILE
2(MESITYLMETHYLENE)MALONONITRILE
246TRIMETHYLBENZYLIDENEMALONONITRILE
CC1=CC(=C(C(=C1)C)C=C(C#N)C#N)C
InChI=1SC13H12N2c19410(2)13(11(3)59)612(714)815h46H13H3
MFCD00453024
PROPANEDINITRILE2(246TRIMETHYLBENZYLYDENE)
ZINC000000042426
ZINC00042426
ZINC42426

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Available files

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