Vitas-M small molecule compound
5-(3-bromo-4,5-dimethoxybenzylidene)-2-butyl-2-methyl-1,3-dioxane-4,6-dione
Catalog ID
STL412285
SMILES CCCCC1(C)OC(=O)/C(=C/c2cc(Br)c(c(c2)OC)OC)/C(=O)O1
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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 C18H21BrO6 MW 413.27 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H21BrO6/c1-5-6-7-18(2)24-16(20)12(17(21)25-18)8-11-9-13(19)15(23-4)14(10-11)22-3/h8-10H,5-7H2,1-4H3/b12-8-InChIKey
IIOQVYKNGQCMHG-WQLSENKSSA-NSynonyms
5(3bromo45dimethoxybenzylidene)2butyl2methyl13dioxane46dione
CCCCC1(C)OC(=O)C(=Cc2cc(Br)c(c(c2)OC)OC)C(=O)O1
MFCD03663030
ZINC000006309771
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