Vitas-M small molecule compound

1-(3-methylpiperidin-1-yl)-2-(pentachlorophenoxy)ethanone

Catalog ID
STK816671
SMILES CC1CCCN(C1)C(=O)COc1c(Cl)c(Cl)c(c(c1Cl)Cl)Cl

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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 C14H14Cl5NO2 MW 405.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C14H14Cl5NO2/c1-7-3-2-4-20(5-7)8(21)6-22-14-12(18)10(16)9(15)11(17)13(14)19/h7H,2-6H2,1H3
InChIKey
MYUKWBYZOWSJLQ-UHFFFAOYSA-N
Synonyms

1((3S)3METHYLPIPERIDIN1YL)2(PENTACHLOROPHENOXY)ETHANONE
1(3methylpiperidin1yl)2(23456pentachlorophenoxy)ethanone
1(3methylpiperidin1yl)2(pentachlorophenoxy)ethanone
CC1CCCN(C1)C(=O)COC2=C(C(=C(C(=C2Cl)Cl)Cl)Cl)Cl
InChI=1SC14H14Cl5NO2c1732420(57)8(21)6221412(18)10(16)9(15)11(17)13(14)19h7H26H21H3
MFCD03993606
ZINC000002825126
ZINC000002825127

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Available files

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