Vitas-M small molecule compound

2-tert-butyl-5-(3,5-dibromo-2-hydroxybenzylidene)-2-methyl-1,3-dioxane-4,6-dione

Catalog ID
STL445255
SMILES Brc1cc(/C=C/2\C(=O)OC(OC2=O)(C)C(C)(C)C)c(c(c1)Br)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 C16H16Br2O5 MW 448.11 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H16Br2O5/c1-15(2,3)16(4)22-13(20)10(14(21)23-16)6-8-5-9(17)7-11(18)12(8)19/h5-7,19H,1-4H3/b10-6-
InChIKey
FFDHEVKMAZRMPJ-POHAHGRESA-N
Synonyms

2tertbutyl5(35dibromo2hydroxybenzylidene)2methyl13dioxane46dione
Brc1cc(C=C2C(=O)OC(OC2=O)(C)C(C)(C)C)c(c(c1)Br)O
MFCD04221483
ZINC000001405977

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Available files

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