Vitas-M small molecule compound

{[5-bromo-3-cyano-4-(methoxymethyl)-6-methylpyridin-2-yl]oxy}acetic acid

Catalog ID
STK667181
SMILES COCc1c(C#N)c(OCC(=O)O)nc(c1Br)C

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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 C11H11BrN2O4 MW 315.12 g/mol Purity >90% as per NMR
InChI
InChI=1S/C11H11BrN2O4/c1-6-10(12)8(4-17-2)7(3-13)11(14-6)18-5-9(15)16/h4-5H2,1-2H3,(H,15,16)
InChIKey
ZBCVUKKYCFGHFC-UHFFFAOYSA-N
Synonyms

((5BROMO3CYANO4(METHOXYMETHYL)6METHYL2PYRIDINYL)OXY)ACETICACID
((5bromo3cyano4(methoxymethyl)6methylpyridin2yl)oxy)aceticacid
2(5BROMO3CYANO4(METHOXYMETHYL)6METHYLPYRIDIN2YL)OXYACETICACID
CC1=C(C(=C(C(=N1)OCC(=O)O)C#N)COC)Br
InChI=1SC11H11BrN2O4c1610(12)8(4172)7(313)11(146)1859(15)16h45H212H3(H1516)
MFCD04086741
ZINC000000361659
ZINC361659

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Available files

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