Vitas-M small molecule compound

azepan-1-yl(3-fluorophenyl)methanone

Catalog ID
STK414388
SMILES Fc1cccc(c1)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 C13H16FNO MW 221.27 g/mol Purity >90% as per NMR
InChI
InChI=1S/C13H16FNO/c14-12-7-5-6-11(10-12)13(16)15-8-3-1-2-4-9-15/h5-7,10H,1-4,8-9H2
InChIKey
WXKIKIHQHWQYBW-UHFFFAOYSA-N
Synonyms
424816-78-4
1((3FLUOROPHENYL)CARBONYL)AZEPANE
1(3FLUOROBENZOYL)AZEPANE
424816784
AZAPERHYDROEPINYL3FLUOROPHENYLKETONE
azepan1yl(3fluorophenyl)methanone
C1CCCN(CC1)C(=O)C2=CC(=CC=C2)F
InChI=1SC13H16FNOc141275611(1012)13(16)1583124915h5710H1489H2
MFCD01355729
ZINC000002741872
ZINC02741872
ZINC2741872

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Available files

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