CymitQuimica logo

CAS 779331-14-5

:

1,1-Dimethylethyl (2S)-2-[2-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-4-(trifluoromethyl)phenoxy]propanoate

Description:
1,1-Dimethylethyl (2S)-2-[2-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-4-(trifluoromethyl)phenoxy]propanoate, with CAS number 779331-14-5, is a chemical compound characterized by its complex structure that includes a propanoate moiety, a phenoxy group, and a boron-containing dioxaborolane. This compound typically exhibits properties associated with both organic and organoboron chemistry, making it of interest in various applications, including pharmaceuticals and agrochemicals. The presence of the trifluoromethyl group enhances its lipophilicity and biological activity, while the dioxaborolane moiety may contribute to its reactivity and stability. The stereochemistry indicated by the (2S) designation suggests specific spatial arrangements that can influence the compound's interactions and efficacy in biological systems. Overall, this compound's unique structural features and functional groups suggest potential utility in synthetic chemistry and medicinal applications, although specific reactivity and stability characteristics would depend on the context of its use.
Formula:C20H28BF3O5
InChI:InChI=1S/C20H28BF3O5/c1-12(16(25)27-17(2,3)4)26-15-10-9-13(20(22,23)24)11-14(15)21-28-18(5,6)19(7,8)29-21/h9-12H,1-8H3/t12-/m0/s1
InChI key:InChIKey=VSAGHWUVBOTIOR-LBPRGKRZSA-N
SMILES:O([C@H](C(OC(C)(C)C)=O)C)C1=C(B2OC(C)(C)C(C)(C)O2)C=C(C(F)(F)F)C=C1
Synonyms:
  • 1,1-Dimethylethyl (2S)-2-[2-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-4-(trifluoromethyl)phenoxy]propanoate
  • Propanoic acid, 2-[2-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-4-(trifluoromethyl)phenoxy]-, 1,1-dimethylethyl ester, (2S)-
  • (S)-2-[2-(4,4,5,5-Tetramethyl-1,3,2-dioxaborolan-2-yl)-4-(trifluoromethyl)phenoxy]propanoic acid 1,1-dimethylethyl ester
  • (2S)-2-[2-(4,4,5,5-Tetramethyl-1,3,2-dioxaborolan-2-yl)-4-(trifluoromethyl)phenoxy]propanoic acid 1,1-dimethylethyl ester
Sort by
The purity filter is not visible because current products do not have associated purity data for filtering.
Found 1 products.