Vitas-M small molecule compound

2-(4-chloro-2-methylphenoxy)-1-(1,4-dioxa-8-azaspiro[4.5]dec-8-yl)ethanone

Catalog ID
STK484466
SMILES Clc1ccc(c(c1)C)OCC(=O)N1CCC2(CC1)OCCO2

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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 C16H20ClNO4 MW 325.79 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H20ClNO4/c1-12-10-13(17)2-3-14(12)20-11-15(19)18-6-4-16(5-7-18)21-8-9-22-16/h2-3,10H,4-9,11H2,1H3
InChIKey
PTCGBCTWKIFTKN-UHFFFAOYSA-N
Synonyms

1(14DIOXA8AZASPIRO(45)DEC8YL)2(4CHLORO2METHYLPHENOXY)ETHAN1ONE
2(4chloro2methylphenoxy)1(14dioxa8azaspiro(45)dec8yl)ethanone
2(4chloro2methylphenoxy)1(14dioxa8azaspiro(45)decan8yl)ethanone
CC1=C(C=CC(=C1)Cl)OCC(=O)N2CCC3(CC2)OCCO3
InChI=1SC16H20ClNO4c1121013(17)2314(12)201115(19)186416(5718)21892216h2310H4911H21H3
MFCD08724770
ZINC000013325991
ZINC13325991

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Available files

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