(1S,2S)-(+)-[1,2-Cyclohexanediamino-N,N'-bis(3,5-di-t-butylsalicylidene)]manganese(III) chloride, 98% (S,S)-Jacobsen Cat.

• CAS: 135620-04-1
• Catalog Number: ACM135620041
• Category: Other Products
• Molecular Weight: 708.128g/mol
• Molecular Formula: C36H54Cl3MnN2O2
• Synonyms: 135620-04-1;(S,S)-[N,N'-Bis(3,5-di-tert-butylsalicylidene)-1,2-cyclohexanediamine]manganese(III) chloride;(S,S)-(N,N'-Bis(3,5-di-tert-butylsalicylidene)-1,2-cyclohexanediamine)manganese(III) chloride;C36H52ClMnN2O2;MFCD02101663;(S,S)-(+)-N,N'-Bis(3,5-di-tert-butylsalicylidene)-1,2-cyclohexanediaminomanganese(III)chloride;(S,S)-Jacobsen's catalyst(S, S) -(+)- N,N' -Bis (3,5 Di- tert -Butylsalicylidene)- 1,2 -Cyclohexanediaminomanganese (III) chloride
• IUPAC Name: 2,4-ditert-butyl-6-[[(1S,2S)-2-[(3,5-ditert-butyl-2-hydroxyphenyl)methylideneamino]cyclohexyl]iminomethyl]phenol;manganese(3+);trichloride
• Canonical SMILES: CC(C)(C)C1=CC(=C(C(=C1)C=NC2CCCCC2N=CC3=CC(=CC(=C3O)C(C)(C)C)C(C)(C)C)O)C(C)(C)C.[Cl-].[Cl-].[Cl-].[Mn+3]
• InChI: InChI=1S/C36H54N2O2.3ClH.Mn/c1-33(2,3)25-17-23(31(39)27(19-25)35(7,8)9)21-37-29-15-13-14-16-30(29)38-22-24-18-26(34(4,5)6)20-28(32(24)40)36(10,11)12;;;;/h17-22,29-30,39-40H,13-16H2,1-12H3;3*1H;/q;;;;+3/p-3/t29-,30-;;;;/m0..../s1
• InChI Key: VGAJDQCIDNCJQC-FTKQXCDWSA-K
• Application: Catalyst for the conversion of olefins to chiral epoxides in high enantiomeric excess.; ; Pharmaceutically important, single enantiomer amino alcohols are efficiently produced from the corresponding chiral epoxide by acid or base-catalyzed epoxide ring-opening reactions.; ; Asymmetric Kinetic resolution of secondary alcohols in water.; ; Enantioselective Reformatsky reaction with ketones.
• Complexity: 793
• Covalently-Bonded Unit Count: 5
• Defined Atom Stereocenter Count: 2
• EC Number: 603-926-9
• Exact Mass: 706.263g/mol
• H-Bond Acceptor: 7
• H-Bond Donor: 2
• Heavy Atom Count: 44
• Monoisotopic Mass: 706.263g/mol
• Rotatable Bond Count: 8
• Topological Polar Surface Area: 65.2A^2