CAS 84029-75-4

5,7,12-Trioxa-6-stannahexacosa-2,9-dienoic acid, 6-butyl-6-[[1,4-dioxo-4-(tetradecyloxy)-2-butenyl]oxy]-4,8,11-trioxo-, tetradecyl ester, (Z,Z,Z)-

Description:

5,7,12-Trioxa-6-stannahexacosa-2,9-dienoic acid, 6-butyl-6-[[1,4-dioxo-4-(tetradecyloxy)-2-butenyl]oxy]-4,8,11-trioxo-, tetradecyl ester, (Z,Z,Z)-, is a complex organometallic compound characterized by its unique structure that includes a stannane (tin-containing) moiety and multiple functional groups such as dioxo and ester functionalities. This compound is likely to exhibit properties typical of organotin compounds, including potential applications in materials science or as a catalyst due to the presence of tin. The presence of multiple oxygen atoms suggests it may have interesting solubility characteristics and reactivity, particularly in organic solvents. The long tetradecyl chain indicates that it may possess surfactant properties, potentially making it useful in formulations requiring emulsification or stabilization. Additionally, the specific stereochemistry (Z,Z,Z) implies that the compound may have distinct geometric isomerism, which can influence its biological activity and interaction with other molecules. Overall, this compound's complexity suggests a range of potential applications in various fields, including pharmaceuticals, materials science, and catalysis.

Formula: C₅₈H₁₀₂O₁₂Sn

InChI: InChI=1S/3C18H32O4.C4H9.Sn/c3*1-2-3-4-5-6-7-8-9-10-11-12-13-16-22-18(21)15-14-17(19)20;1-3-4-2;/h3*14-15H,2-13,16H2,1H3,(H,19,20);1,3-4H2,2H3;/q;;;;+3/p-3/b3*15-14-;;

InChI key: InChIKey=SIGMQEZAKTZEPF-DWUHLOFKSA-K

SMILES: [Sn](OC(/C=C\C(OCCCCCCCCCCCCCC)=O)=O)(OC(/C=C\C(OCCCCCCCCCCCCCC)=O)=O)(OC(/C=C\C(OCCCCCCCCCCCCCC)=O)=O)CCCC

Synonyms:

• 5,7,12-Trioxa-6-stannahexacosa-2,9-dienoic acid, 6-butyl-6-[[1,4-dioxo-4-(tetradecyloxy)-2-butenyl]oxy]-4,8,11-trioxo-, tetradecyl ester, (Z,Z,Z)-
• tetradecyl [butyl-bis[[(Z)-4-oxo-4-tetradecoxy-but-2-enoyl]oxy]stannyl] (Z)-but-2-enedioate
• Tetradecyl (Z,Z,Z)-6-butyl-6-((1,4-dioxo-4-(tetradecyloxy)but-2-enyl)oxy)-4,8,11-trioxo-5,7,12-trioxa-6-stannahexacosa-2,9-dienoate