Vitas-M small molecule compound

azepan-1-yl(4-ethoxy-3-methylphenyl)methanone

Catalog ID
STL223180
SMILES CCOc1ccc(cc1C)C(=O)N1CCCCCC1

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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 C16H23NO2 MW 261.36 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H23NO2/c1-3-19-15-9-8-14(12-13(15)2)16(18)17-10-6-4-5-7-11-17/h8-9,12H,3-7,10-11H2,1-2H3
InChIKey
MVJBMFUMOSMPFP-UHFFFAOYSA-N
Synonyms

azepan1yl(4ethoxy3methylphenyl)methanone
CCOC1=C(C=C(C=C1)C(=O)N2CCCCCC2)C
InChI=1SC16H23NO2c1319159814(1213(15)2)16(18)171064571117h8912H371011H212H3
MFCD09671041
ZINC000013582377
ZINC13582377

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Available files

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