Vitas-M small molecule compound

3-(3,4-dimethoxyphenyl)pentanedioic acid

Catalog ID
STK696449
SMILES COc1cc(ccc1OC)C(CC(=O)O)CC(=O)O

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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/c1-18-10-4-3-8(5-11(10)19-2)9(6-12(14)15)7-13(16)17/h3-5,9H,6-7H2,1-2H3,(H,14,15)(H,16,17)
InChIKey
TZSDBIPKDYTSKC-UHFFFAOYSA-N
Synonyms
34811-27-3
3(34DIMETHOXYPHENYL)GLUTARICACID
3(34dimethoxyphenyl)pentanedioicacid
34811273
COC1=C(C=C(C=C1)C(CC(=O)O)CC(=O)O)OC
InChI=1SC13H16O6c11810438(511(10)192)9(612(14)15)713(16)17h359H67H212H3(H1415)(H1617)
MFCD00500803
ZINC000005074141
ZINC5074141

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Available files

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