Vitas-M small molecule compound

N-(4-cyanophenyl)-2,2-dimethylbutanamide

Catalog ID
STK117396
SMILES CCC(C(=O)Nc1ccc(cc1)C#N)(C)C

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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 C13H16N2O MW 216.28 g/mol Purity >90% as per NMR
InChI
InChI=1S/C13H16N2O/c1-4-13(2,3)12(16)15-11-7-5-10(9-14)6-8-11/h5-8H,4H2,1-3H3,(H,15,16)
InChIKey
BFHWRUFUUUXFBZ-UHFFFAOYSA-N
Synonyms
349438-07-9
349438079
CCC(C)(C)C(=O)NC1=CC=C(C=C1)C#N
InChI=1SC13H16N2Oc1413(23)12(16)15117510(914)6811h58H4H213H3(H1516)
MFCD02861183
N(4CYANOPHENYL)22DIMETHYLBUTANAMIDE
ZINC000004691007
ZINC04691007
ZINC4691007

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Available files

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