Vitas-M small molecule compound

N,N-bis(cyanomethyl)-3,4-dimethylbenzamide

Catalog ID
STK018844
SMILES N#CCN(C(=O)c1ccc(c(c1)C)C)CC#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 C13H13N3O MW 227.27 g/mol Purity >90% as per NMR
InChI
InChI=1S/C13H13N3O/c1-10-3-4-12(9-11(10)2)13(17)16(7-5-14)8-6-15/h3-4,9H,7-8H2,1-2H3
InChIKey
PVXVKOMTIBHCGI-UHFFFAOYSA-N
Synonyms
333348-20-2
(34DIMETHYLPHENYL)NNBIS(CYANOMETHYL)CARBOXAMIDE
333348202
CC1=C(C=C(C=C1)C(=O)N(CC#N)CC#N)C
InChI=1SC13H13N3Oc1103412(911(10)2)13(17)16(7514)8615h349H78H212H3
MFCD01215966
N#CCN(C(=O)c1ccc(c(c1)C)C)CC#N
NNBIS(CYANOMETHYL)34DIMETHYLBENZAMIDE
NNBISCYANOMETHYL34DIMETHYLBENZAMIDE
STK018844
ZINC000000029940
ZINC00029940
ZINC29940

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Available files

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