Vitas-M small molecule compound

dibutyl 2,2'-[(4-methyl-2-oxo-2H-chromene-5,7-diyl)bis(oxy)]diacetate

Catalog ID
STK713367
SMILES CCCCOC(=O)COc1cc(OCC(=O)OCCCC)c2c(c1)oc(=O)cc2C

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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 C22H28O8 MW 420.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H28O8/c1-4-6-8-26-20(24)13-28-16-11-17(29-14-21(25)27-9-7-5-2)22-15(3)10-19(23)30-18(22)12-16/h10-12H,4-9,13-14H2,1-3H3
InChIKey
VSQSQKBJHGMWIL-UHFFFAOYSA-N
Synonyms

BUTYL2(5(2BUTOXY2OXOETHOXY)4METHYL2OXOCHROMEN7YL)OXYACETATE
CCCCOC(=O)COC1=CC(=C2C(=CC(=O)OC2=C1)C)OCC(=O)OCCCC
dibutyl22((4methyl2oxo2Hchromene57diyl)bis(oxy))diacetate
InChI=1SC22H28O8c14682620(24)1328161117(291421(25)279752)2215(3)1019(23)3018(22)1216h1012H491314H213H3
MFCD01238122
ZINC000004746067
ZINC04746067
ZINC4746067

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Available files

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