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

Catalog Number

ACM135620041

Product Name

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

Structure

CAS

135620-04-1

Category

Heterocyclic Organic Compound

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;

Molecular Weight

708.128g/mol

Molecular Formula

C36H54Cl3MnN2O2;

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

MSDS

COA

Spec Sheet