5-[Bis(methylthio)methylene]-2,2-dimethyl-1,3-dioxane-4,6-dione

CAS: 100981-05-3

Ref. TR-B485958

Product Information

• Name: 5-[Bis(methylthio)methylene]-2,2-dimethyl-1,3-dioxane-4,6-dione
• Synonyms: 5-[Bis(methylsulfanyl)methylene]-2,2-dimethyl-[1,3]dioxan-4,6-dione, 5-[Bis(methylsulfanyl)methylene]-2,2-dimethyl-[1,3]dioxane-4,6-dione, Isopropylidene [Bis(methylthio)methylene]malonate, Bis(Methylthio)Methylene Meldrums Acid, Thioketal

Description

Stability Moisture Sensitive
Applications 5-[Bis(methylthio)methylene]-2,2-dimethyl-1,3-dioxane-4,6-dione is a derivative of Meldrum’s Acid (M215250), which is an antimicrobial agent. 5-[Bis(methylthio)methylene]-2,2-dimethyl-1,3-dioxane-4,6-dione is a synthetic intermediate in the preparation of TGX 115 phosphoinositide 3-kinase inhibitor.
References Nelson, N., et al.: J. Biol. Chem., 245, 143 (1970); Kawamura, M., et al.: Plant Cell Physiol., 21, 745 (1980); Oettmeier, W., et al.: Biochim. Biophys Acta, 890, 260 (1987); Knight, Z., et al.: Bioorg. Med. Chem., 12, 4749 (2004);

• Brand: TRC

Chemical properties

• Molecular weight: 248.32
• Formula: C₉H₁₂O₄S₂
• Color/Form: Yellow to Dark Yellow Solid
• InChI: InChI=1S/C9H12O4S2/c1-9(2)12-6(10)5(7(11)13-9)8(14-3)15-4/h1-4H3
• InChI key: InChIKey=OCIGQKNRHXFMQJ-UHFFFAOYSA-N
• SMILES: CSC(SC)=C1C(=O)OC(C)(C)OC1=O