Vitas-M small molecule compound

(2,5-dimethoxybenzylidene)propanedinitrile

Catalog ID
STL137662
SMILES COc1ccc(cc1C=C(C#N)C#N)OC

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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 C12H10N2O2 MW 214.22 g/mol Purity >90% as per NMR
InChI
InChI=1S/C12H10N2O2/c1-15-11-3-4-12(16-2)10(6-11)5-9(7-13)8-14/h3-6H,1-2H3
InChIKey
SHAPCXXRYMVHIF-UHFFFAOYSA-N
Synonyms
2972-75-0
((25DIMETHOXYPHENYL)METHYLENE)METHANE11DICARBONITRILE
(25dimethoxybenzylidene)propanedinitrile
2((25DIMETHOXYPHENYL)METHYLIDENE)PROPANEDINITRILE
2(25DIMETHOXYBENZYLIDENE)MALONONITRILE
25DIMETHOXYBENZYLIDENEMALONONITRILE
2972750
COC1=CC(=C(C=C1)OC)C=C(C#N)C#N
InChI=1SC12H10N2O2c115113412(162)10(611)59(713)814h36H12H3
MFCD00174819
PROPANEDINITRILE((25DIMETHOXYPHENYL)METHYLENE)
ZINC000000097264
ZINC00097264
ZINC97264

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Available files

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