S,S-Jacobsen catalyst

CAS Registry Number®

135620-04-1

CAS Name

S,S-Jacobsen catalyst

Molecular Formula

C36H52ClMnN2O2

Cite this Page

S,S-Jacobsen catalyst.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=135620-04-1 (retrieved 2024-11-13) (CAS RN: 135620-04-1).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C36H54N2O2.ClH.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;1H;/q;;+3/p-3/t29-,30-;;/m0../s1

InChIKey

InChIKey=LJVAWOSDJSQANR-ARDORAJISA-K

SMILES

[Cl-][Mn+3]123[N]([C@@]4([C@@]([N]1=CC=5C([O-]2)=C(C(C)(C)C)C=C(C(C)(C)C)C5)(CCCC4)[H])[H])=CC=6C([O-]3)=C(C(C)(C)C)C=C(C(C)(C)C)C6

Canonical SMILES

[Cl-][Mn+3]123[O-]C4=C(C=C(C=C4C(C)(C)C)C(C)(C)C)C=[N]3C5CCCCC5[N]2=CC=6C=C(C=C(C6[O-]1)C(C)(C)C)C(C)(C)C

Other Names for this Substance

  • Manganese, chloro[[2,2′-[(1S,2S)-1,2-cyclohexanediylbis[(nitrilo-κN)methylidyne]]bis[4,6-bis(1,1-dimethylethyl)phenolato-κO]](2-)]-, (SP-5-13)-
  • Manganese, chloro[[2,2′-[1,2-cyclohexanediylbis[(nitrilo-κN)methylidyne]]bis[4,6-bis(1,1-dimethylethyl)phenolato-κO]](2-)]-, [SP-5-13-(1S-trans)]-
  • Phenol, 2,2′-[1,2-cyclohexanediylbis(nitrilomethylidyne)]bis[4,6-bis(1,1-dimethylethyl)-, manganese complex, (1S-trans)-
  • (SP-5-13)-Chloro[[2,2′-[(1S,2S)-1,2-cyclohexanediylbis[(nitrilo-κN)methylidyne]]bis[4,6-bis(1,1-dimethylethyl)phenolato-κO]](2-)]manganese
  • Manganese, chloro[[2,2′-[1,2-cyclohexanediylbis(nitrilomethylidyne)]bis[4,6-bis(1,1-dimethylethyl)phenolato]](2-)-N,N′,O,O′]-, [SP-5-13-(1S-trans)]-

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