CAS 125175-64-6
:2,2-Dimethylbutanoic Acid [3R-[3a,5,5aa,6a(2R*,4R*),7a,9aS*]]-6-[2-[4-[[(1,1-Dimethylethyl)dimethylsilyl]oxy]tetrahydro-6-oxo-2H-pyran-2-yl]ethyl]-3,4,5,5a,6,7-hexahydro-7-methyl-2H-3,9a-methano-1-benzoxepin-5-yl Ester
Description:
2,2-Dimethylbutanoic acid, with the CAS number 125175-64-6, is a complex organic compound characterized by its branched structure and the presence of a carboxylic acid functional group. This substance features a dimethyl substitution on the second carbon of a butanoic acid backbone, which contributes to its unique physical and chemical properties. The presence of multiple stereocenters indicates that it can exist in various stereoisomeric forms, affecting its reactivity and interactions with biological systems. The compound is likely to be a solid at room temperature, with moderate solubility in polar solvents due to the carboxylic acid group, which can engage in hydrogen bonding. Its intricate structure suggests potential applications in pharmaceuticals or as a synthetic intermediate in organic chemistry. Additionally, the presence of silyl and tetrahydropyran moieties may enhance its stability and reactivity, making it a subject of interest in synthetic organic chemistry and medicinal chemistry research.
Formula:C31H52O6Si
InChI:InChI=1/C31H52O6Si/c1-10-30(6,7)28(33)36-25-15-21-18-31(34-19-21)14-13-20(2)24(27(25)31)12-11-22-16-23(17-26(32)35-22)37-38(8,9)29(3,4)5/h13-14,20-25,27H,10-12,15-19H2,1-9H3/t20-,21+,22+,23+,24-,25-,27-,31+/m0/s1
Synonyms:- 4a’,6’-Anhydro-4-tert-butyldimethylsilyl Simvastatin
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Butanoic acid, 2,2-dimethyl-, 6-[2-[4-[[(1,1-dimethylethyl)dimethylsilyl]oxy]tetrahydro-6-oxo-2H-pyran-2-yl]ethyl]-3,4,5,5a,6,7-hexahydro-7-methyl-2H-3,9a-methano-1-benzoxepin-5-yl ester, [3R-[3α,5β,5aα,6α(2R*,4R*),7α,9aS*]]- (9CI)
CAS:Formula:C31H52O6SiColor and Shape:SolidMolecular weight:548.8265
