Structure

Dichloro[(S)-(-)-2,2',6,6'-tetramethoxy-4,4'-bis(diphenylphosphino)-3,3'-bipyridine][(1S,2S)-(-)-1,2-diphenylethylenediamine]ruthenium(II), min. 95%

CAS
821793-36-6
Catalog Number
ACM821793366
Category
Other Products
Molecular Weight
1030.93g/mol
Molecular Formula
C52H52Cl2N4O4P2Ru;

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Specification

Synonyms
821793-36-6;(R)-P-Phos RuCl2 (R,R)-DPEN;(S)-P-Phos RuCl2 (S,S)-DPEN;Dichloro[(R)-4,4'-bis(diphenylphosphino)-2,2',6,6'-tetramethoxy-3,3'-bipyridine][(R,R)-DPEN]ruthenium(II);Dichloro[(S)-4,4'-bis(diphenylphosphino)-2,2',6,6'-tetramethoxy-3,3'-bipyridine][(S,S)-DPEN]ruthenium(II);
IUPAC Name
(1S,2S)-1,2-diphenylethane-1,2-diamine;[3-(4-diphenylphosphaniumyl-2,6-dimethoxypyridin-3-yl)-2,6-dimethoxypyridin-4-yl]-diphenylphosphanium;ruthenium;dichloride;
SMILES
COC1=NC(=C(C(=C1)[PH+](C2=CC=CC=C2)C3=CC=CC=C3)C4=C(N=C(C=C4[PH+](C5=CC=CC=C5)C6=CC=CC=C6)OC)OC)OC.C1=CC=C(C=C1)C(C(C2=CC=CC=C2)N)N.[Cl-].[Cl-].[Ru];
InChI
InChI=1S/C38H34N2O4P2.C14H16N2.2ClH.Ru/c1-41-33-25-31(45(27-17-9-5-10-18-27)28-19-11-6-12-20-28)35(37(39-33)43-3)36-32(26-34(42-2)40-38(36)44-4)46(29-21-13-7-14-22-29)30-23-15-8-16-24-30;15-13(11-7-3-1-4-8-11)14(16)12-9-5-2-6-10-12;;;/h5-26H,1-4H3;1-10,13-14H,15-16H2;2*1H;/t;13-,14-;;;/m.0.../s1;
InChI Key
ONPAXHVWKWGZOZ-LISIALKWSA-N;
Application
Effective catalyst for the highly enantioselective hydrogenation of a diverse range of simple aromatic ketones.
Complexity
949
Covalently-Bonded Unit Count
5
Defined Atom Stereocenter Count
2
Exact Mass
1030.188g/mol
H-Bond Acceptor
10
H-Bond Donor
2
Heavy Atom Count
65
Monoisotopic Mass
1030.188g/mol
Rotatable Bond Count
11
Topological Polar Surface Area
115A^2
January 20, 2023


An effective chiral catalyst
In the catalytic reaction, dichloro[(S)-(-)-2,2',6,6'-tetramethoxy-4,4'-bis(diphenylphosphino)-3,3'-bipyridine][(1S,2S)-(-)-1,2-diphenylethylenediamine]ruthenium(II) is an effective catalyst for the high enantioselectivity hydrogenation of simple aromatic ketones.

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