(S)-5,5-Diphenyl-2-methyl-3,4-propano-1,3,2-oxazaborolidine

• CAS: 112022-81-8
• Catalog Number: ACM112022818
• Category: Other
• Molecular Weight: 277.174g/mol
• Molecular Formula: C18H20BNO
• Synonyms: AKOS015840981; (S)-1-methyl-3,3-diphenyltetrahydro-1H,3H-pyrrolo[1,2-c][1,3,2]oxazaborole; MFCD00078439; (S)- Methyl-CBS-oxazaborolidine; ZINC169743318; (S)-tetrahydro-1-methyl-3,3-diphenyl-1 H,3 H-pyrrolo[1,2-c][1,3,2] oxazaborole; (S)-1-methyl-3,3-diphenylhexahydropyrrolo-[1,2-c][1,3,2]oxazaborole; (S)-tetrahydro-1-methyl-3,3-diphenyl-1 H,3H-pyrrolo[1,2-c]-[1,3,2]oxazaborole; (S)-Me-CBS; Corey catalyst
• IUPAC Name: (3aS)-1-methyl-3,3-diphenyl-3a,4,5,6-tetrahydropyrrolo[1,2-c][1,3,2]oxazaborole
• Canonical SMILES: B1(N2CCCC2C(O1)(C3=CC=CC=C3)C4=CC=CC=C4)C
• InChI: InChI=1S/C18H20BNO/c1-19-20-14-8-13-17(20)18(21-19,15-9-4-2-5-10-15)16-11-6-3-7-12-16/h2-7,9-12,17H,8,13-14H2,1H3/t17-/m0/s1
• InChI Key: VMKAFJQFKBASMU-KRWDZBQOSA-N
• Application: Convenient catalyst for the enantioselective borane reduction of ketones at ambient temperatures.; ; Asymmetric synthesis of α-chiral hydroxyalkylphosphines via a catalytic, enantioselective reduction of acylphosphines.; ; Nickel-catalyzed cross-couplings of benzylic pivalates with arylboroxines: Stereospecific formation of diarylalkanes and triarylmethanes.; ; Enantioselective reduction of prochiral ketones with NaBH4/Me2SO4/(S)-Me-CBS.
• Storage: Refrigerator
• Complexity: 344
• Covalently-Bonded Unit Count: 1
• Defined Atom Stereocenter Count: 1
• Exact Mass: 277.164g/mol
• H-Bond Acceptor: 2
• Heavy Atom Count: 21
• Monoisotopic Mass: 277.164g/mol
• Rotatable Bond Count: 2
• Topological Polar Surface Area: 12.5A^2