Vitas-M small molecule compound

2-[1-(benzylamino)ethylidene]cyclohexane-1,3-dione

Catalog ID
STK526657
SMILES CC(=C1C(=O)CCCC1=O)NCc1ccccc1

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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 C15H17NO2 MW 243.31 g/mol Purity >90% as per NMR
InChI
InChI=1S/C15H17NO2/c1-11(15-13(17)8-5-9-14(15)18)16-10-12-6-3-2-4-7-12/h2-4,6-7,16H,5,8-10H2,1H3
InChIKey
UTTZOOBXQZOYOZ-UHFFFAOYSA-N
Synonyms

2(1(benzylamino)ethylidene)cyclohexane13dione
CC(=C1C(=O)CCCC1=O)NCC2=CC=CC=C2
InChI=1SC15H17NO2c111(1513(17)85914(15)18)1610126324712h246716H5810H21H3
MFCD02163467
ZINC000100639844
ZINC100639844

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Available files

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