Vitas-M small molecule compound

1-(azepan-1-yl)-2-(2-chloro-5-methylphenoxy)ethanone

Catalog ID
STK464647
SMILES O=C(N1CCCCCC1)COc1cc(C)ccc1Cl

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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 C15H20ClNO2 MW 281.78 g/mol Purity >90% as per NMR
InChI
InChI=1S/C15H20ClNO2/c1-12-6-7-13(16)14(10-12)19-11-15(18)17-8-4-2-3-5-9-17/h6-7,10H,2-5,8-9,11H2,1H3
InChIKey
NXZPJLUFSXJZDM-UHFFFAOYSA-N
Synonyms

1(azepan1yl)2(2chloro5methylphenoxy)ethanone
1AZAPERHYDROEPINYL2(2CHLORO5METHYLPHENOXY)ETHAN1ONE
CC1=CC(=C(C=C1)Cl)OCC(=O)N2CCCCCC2
InChI=1SC15H20ClNO2c1126713(16)14(1012)191115(18)1784235917h6710H258911H21H3
MFCD06624748
ZINC000002872561
ZINC02872561
ZINC2872561

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Available files

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