Vitas-M small molecule compound

3-cyano-1-(2-cyclopropyl-2-oxoethyl)pyridinium

Catalog ID
STL320758
SMILES N#Cc1ccc[n+](c1)CC(=O)C1CC1

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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 C11H11N2O MW 187.22 g/mol Purity >90% as per NMR
InChI
InChI=1S/C11H11N2O/c12-6-9-2-1-5-13(7-9)8-11(14)10-3-4-10/h1-2,5,7,10H,3-4,8H2/q+1
InChIKey
IRLMNELDEOKMRM-UHFFFAOYSA-N
Synonyms

1(2CYCLOPROPYL2OXOETHYL)PYRIDIN1IUM3CARBONITRILE
3cyano1(2cyclopropyl2oxoethyl)pyridinium
C1CC1C(=O)C(N+)2=CC=CC(=C2)C#N
InChI=1SC11H11N2Oc126921513(79)811(14)103410h125710H348H2q+1
MFCD01086966
N#Cc1ccc(n+)(c1)CC(=O)C1CC1
ZINC000001829421
ZINC01829421
ZINC1829421

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Available files

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