(S,S)-(+)-N,N'-Bis(3,5-di-tert-butylsalicylidene)-1,2-diaminocyclohexylmanganese(III) chloride

Base Information

• Chemical Name: (S,S)-(+)-N,N'-Bis(3,5-di-tert-butylsalicylidene)-1,2-diaminocyclohexylmanganese(III) chloride
• CAS No.: 135620-04-1
• Molecular Formula: C₃₆H₅₂ClMnN₂O₂
• Molecular Weight: 635.212
• Hs Code.: 29310099
• European Community (EC) Number: 603-926-9
• UNII: RIM5C05I0Z
• Mol file: 135620-04-1.mol

Synonyms:KJB-002;(S,S)-Jacobsen's catalyst;UNII-RIM5C05I0Z;135620-04-1;RIM5C05I0Z;(S,S)-(+)-N,N'-Bis(3,5-di-tert-butylsalicylidene)-1,2-diaminocyclohexylmanganese(III) chloride;(N,N'-Bis(3,5-di-tert-butylsalicylidene)-1,2-cyclohexanediamine)manganese(III) chloride, (S,S)-;(S,S)-(N,N'-Bis(3,5-di-tert-butylsalicylidene)-1,2-cyclohexanediamine)manganese(III) chloride;2,4-ditert-butyl-6-[[(1S,2S)-2-[(3,5-ditert-butyl-2-oxidophenyl)methylideneamino]cyclohexyl]iminomethyl]phenolate;manganese(3+);chloride;Manganese, chloro((2,2'-((1S,2S)-1,2-cyclohexanediylbis((nitrilo-kappaN)methylidyne))bis(4,6-bis(1,1-dimethylethyl)phenolato-kappaO))(2-))-, (sp-5-13)-;(S,S)-(+)-N,N'-BIS(3,5-DI-TERT-BUTYLSALICYLIDENE)-1,2-CYCLOHEXANEDIAMINO-MANGANESE(III) CHLORIDE;(S,S)-(+)-N,N'-Bis(3,5-di-tert-butylsalicylidene)-1,2-cyclohexanediaminomanganese(III) chloride;(S,S)-[N,N'-Bis(3,5-di-tert-butylsalicylidene)-1,2-cyclohexanediamine]manganese(III) chloride;LJVAWOSDJSQANR-ARDORAJISA-K;GEO-03069;(S,S)-(+)-N,N'-bis(3,5-di-tert-butylsalicylidene)-1,2-cyclohexanediamino manganese (III) chloride;(S,S)-(+)-N,N'-bis(3,5-di-tert-butylsalicylidene)-1,2-cyclohexanediaminomanganese(III)-chloride;(S,S)-(+)-N,N/'-BIS(3,5-DI-TERT-BUTYLSALICYLIDENE)-1,2-CYCLOHEXANEDIAMINO-MANGANESE(III) CHLORIDE;MANGANESE, CHLORO((2,2'-((1S,2S)-1,2-CYCLOHEXANEDIYLBIS((NITRILO-.KAPPA.N)METHYLIDYNE))BIS(4,6-BIS(1,1-DIMETHYLETHYL)PHENOLATO-.KAPPA.O))(2-))-, (SP-5-13)-

Chemical Property of (S,S)-(+)-N,N'-Bis(3,5-di-tert-butylsalicylidene)-1,2-diaminocyclohexylmanganese(III) chloride

Chemical Property:

• Appearance/Colour: dark brown powder
• Melting Point: 330-332 °C(lit.)
• PSA: 65.18000
• LogP: 0.14900
• Storage Temp.: Inert atmosphere,Room Temperature
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 5
• Rotatable Bond Count: 8
• Exact Mass: 634.309775
• Heavy Atom Count: 42
• Complexity: 793

Purity/Quality:

98%,99%, ^*data from raw suppliers

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

Safty Information:

• Pictogram(s): Xi
• Hazard Codes: Xi
• Statements: 36/37/38-20/21/22
• Safety Statements: 26-36-36/37/39

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC(C)(C)C1=CC(=C(C(=C1)C(C)(C)C)[O-])C=NC2CCCCC2N=CC3=C(C(=CC(=C3)C(C)(C)C)C(C)(C)C)[O-].[Cl-].[Mn+3]
• Isomeric SMILES: CC(C)(C)C1=CC(=C(C(=C1)C(C)(C)C)[O-])C=N[C@H]2CCCC[C@@H]2N=CC3=C(C(=CC(=C3)C(C)(C)C)C(C)(C)C)[O-].[Cl-].[Mn+3]

Technology Process of (S,S)-(+)-N,N'-Bis(3,5-di-tert-butylsalicylidene)-1,2-diaminocyclohexylmanganese(III) chloride

There total 3 articles about (S,S)-(+)-N,N'-Bis(3,5-di-tert-butylsalicylidene)-1,2-diaminocyclohexylmanganese(III) chloride which guide to synthetic route it. The literature collected by LookChem mainly comes from the sharing of users and the free literature resources found by Internet computing technology. We keep the original model of the professional version of literature to make it easier and faster for users to retrieve and use. At the same time, we analyze and calculate the most feasible synthesis route with the highest yield for your reference as below:

synthetic route:

Reference yield:

manganese(II) acetate (638-38-0,993-02-2,2180-18-9,15411-95-7,22981-23-3,27004-39-3) + =G87N,N'-bis(3,5-di-tert-butylsalicylidene)-1,2-cyclohexane diamine+G2+'12'!J6 (174829-13-1) → Mn(Salen)Cl (138124-32-0,215112-83-7,149656-63-3,170437-19-1,187819-93-8,135620-04-1,1217901-33-1)

Guidance literature:

manganese(II) acetate; =G₈₇N,N'-bis(3,5-di-tert-butylsalicylidene)-1,2-cyclohexane diamine+G₂+'12'!J₆; In ethanol; at 80 ℃; for 3h;

With lithium chloride; In ethanol; for 1h; Reflux;

Reference yield:

manganese (II) acetate tetrahydrate (6156-78-1) + lithium chloride + =G87N,N'-bis(3,5-di-tert-butylsalicylidene)-1,2-cyclohexane diamine+G2+'12'!J6 (174829-13-1) → Mn(Salen)Cl (138124-32-0,215112-83-7,149656-63-3,170437-19-1,187819-93-8,135620-04-1,1217901-33-1)

Guidance literature:

In ethanol; at 79.84 ℃; Reflux;

DOI:10.1016/j.molcata.2016.01.034

Reference yield:

manganese(II) chloride tetrahydrate + =G87N,N'-bis(3,5-di-tert-butylsalicylidene)-1,2-cyclohexane diamine+G2+'12'!J6 (174829-13-1) → Mn(Salen)Cl (138124-32-0,215112-83-7,149656-63-3,170437-19-1,187819-93-8,135620-04-1,1217901-33-1)

Guidance literature:

In ethanol; soln. MnCl2*4H2O and ligand in EtOH was refluxed for 1-2 h; soln. was concd. by evapn., residue was recrystd. from MeCN or EtOH, anddried under vac.;

DOI:10.1039/b309125b

upstream raw materials:

=G87N,N'-bis(3,5-di-tert-butylsalicylidene)-1,2-cyclohexane diamine+G2+'12'!J6

manganese (II) acetate tetrahydrate

manganese(II) acetate

Refernces

• 1、 Garcia, Ana M.,Moreno, Viviana,Delgado, Sonia X.,Ramírez, Alfonso E.,Vargas, Luis A.,Vicente, Miguel á.,Gil, Antonio,Galeano, Luis A.. "Encapsulation of SALEN- and SALHD-Mn(III) complexes in an Al-pillared clay for bicarbonate-assisted catalytic epoxidation of cyclohexene". . p. 10 - 19. Retrieved 2016/02/27.