Vitas-M small molecule compound

4-oxo-4-(2,4,5-trimethoxyphenyl)butanoic acid

Catalog ID
STK055291
SMILES COc1cc(OC)c(cc1C(=O)CCC(=O)O)OC

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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 C13H16O6 MW 268.27 g/mol Purity >90% as per NMR
InChI
InChI=1S/C13H16O6/c1-17-10-7-12(19-3)11(18-2)6-8(10)9(14)4-5-13(15)16/h6-7H,4-5H2,1-3H3,(H,15,16)
InChIKey
MCVJECHMYXGLIU-UHFFFAOYSA-N
Synonyms
31914-19-9
31914199
4(245TRIMETHOXYPHENYL)4OXOBUTYRICACID
4(245TRIMETHOXYPHENYL)4OXOBUTYRICACID97
4OXO4(245TRIMETHOXYPHENYL)BUTANOICACID
4OXO4(245TRIMETHOXYPHENYL)BUTYRICACID
COC1=CC(=C(C=C1C(=O)CCC(=O)O)OC)OC
COc1cc(OC)c(cc1C(=O)CCC(=O)O)OC
InChI=1SC13H16O6c11710712(193)11(182)68(10)9(14)4513(15)16h67H45H213H3(H1516)
MFCD00552969
STK055291
ZINC000000363577
ZINC363577

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Available files

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