Vitas-M small molecule compound

4-tert-butyl-N-(cyanomethyl)benzamide

Catalog ID
STK055198
SMILES N#CCNC(=O)c1ccc(cc1)C(C)(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/c1-13(2,3)11-6-4-10(5-7-11)12(16)15-9-8-14/h4-7H,9H2,1-3H3,(H,15,16)
InChIKey
RTQMUOJAWPOAHM-UHFFFAOYSA-N
Synonyms
329930-77-0
(4(TERTBUTYL)PHENYL)N(CYANOMETHYL)CARBOXAMIDE
329930770
4TERTBUTYLN(CYANOMETHYL)BENZAMIDE
CC(C)(C)C1=CC=C(C=C1)C(=O)NCC#N
InChI=1SC13H16N2Oc113(23)116410(5711)12(16)159814h47H9H213H3(H1516)
MFCD01195464
N#CCNC(=O)c1ccc(cc1)C(C)(C)C
STK055198
ZINC000002745037
ZINC02745037
ZINC2745037

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Available files

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