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(S,S)-(-)-2,2'-Isopropylidenebis(4-tert-butyl-2-oxazoline)

Catalog Number
ACM131833937-3
Product Name
(S,S)-(-)-2,2'-Isopropylidenebis(4-tert-butyl-2-oxazoline)
Structure
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CAS
131833-93-7
  • Product Overview
  • Usage
Synonyms
MFCD00192243; (4S)-4-tert-butyl-2-{2-[(4S)-4-tert-butyl-4,5-dihydro-1,3-oxazol-2-yl]propan-2-yl}-4,5-dihydro-1,3-oxazole; AKOS015838464; CI-458; (S,S)-(-)-2,2'-Isopropylidenebis(4-tert-butyl-2-oxazoline); 2,2'-Isopropylidenebis[(4S)-4-tert-butyl-2-oxazoline]; ZB001872; KS-00000NQ1; CTK4B7549; AC1LELKR;
IUPAC Name
(4S)-4-tert-butyl-2-[2-[(4S)-4-tert-butyl-4,5-dihydro-1,3-oxazol-2-yl]propan-2-yl]-4,5-dihydro-1,3-oxazole;
Molecular Weight
294.439g/mol
Molecular Formula
C17H30N2O2;
Canonical SMILES
CC(C)(C)C1COC(=N1)C(C)(C)C2=NC(CO2)C(C)(C)C;
InChI
InChI=1S/C17H30N2O2/c1-15(2,3)11-9-20-13(18-11)17(7,8)14-19-12(10-21-14)16(4,5)6/h11-12H,9-10H2,1-8H3/t11-,12-/m1/s1;
InChI Key
DPMGLJUMNRDNMX-VXGBXAGGSA-N;
Complexity
422
Covalently-Bonded Unit Count
1
Defined Atom Stereocenter Count
2
Exact Mass
294.231g/mol
H-Bond Acceptor
4
Heavy Atom Count
21
Monoisotopic Mass
294.231g/mol
Rotatable Bond Count
4
Topological Polar Surface Area
43.2A^2
UNII
2268A05V3V
Application
(S,S)-(-)-2,2'-Isopropylidenebis(4-tert-butyl-2-oxazoline) serves as a highly effective chiral catalyst designed for asymmetric synthesis. Its C2 symmetric ligand structure is ideal for enantioselective catalysis, ensuring precise outcomes in chemical reactions. The product is notable for its ability to readily form bidentate coordination complexes, attributed to the strong affinity of the oxazoline nitrogen for various metals. This characteristic enhances its functionality and versatility in catalysis applications.
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