[(S,S)-Teth-TsDpen RuCl]

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Catalog Number
ACM851051439
Product Name
[(S,S)-Teth-TsDpen RuCl]
CAS
851051-43-9
Category
Heterocyclic Organic Compound
Synonyms
[(S,S)-teth-TsDpen-RuCl];851051-43-9;C1-310;Chloro[(S,S)-1,2-diphenyl-N1-(3-phenylpropyl)-N2-(p-toluenesulfonyl)-1,2-ethanediamine]ruthenium(II);
IUPAC Name
chlororuthenium(1+);[(1S,2S)-1,2-diphenyl-2-(3-phenylpropylamino)ethyl]-(4-methylphenyl)sulfonylazanide;
Molecular Weight
620.17g/mol
Molecular Formula
C30H31ClN2O2RuS;
Canonical SMILES
CC1=CC=C(C=C1)S(=O)(=O)[N-]C(C2=CC=CC=C2)C(C3=CC=CC=C3)NCCCC4=CC=CC=C4.Cl[Ru+];
InChI
InChI=1S/C30H31N2O2S.ClH.Ru/c1-24-19-21-28(22-20-24)35(33,34)32-30(27-17-9-4-10-18-27)29(26-15-7-3-8-16-26)31-23-11-14-25-12-5-2-6-13-25;;/h2-10,12-13,15-22,29-31H,11,14,23H2,1H3;1H;/q-1;;+2/p-1/t29-,30-;;/m0../s1;
InChI Key
MDABGVLQRDDWLY-ARDORAJISA-M;
Application
Catalyst used for asymmetric -transfer hydrogenation.
Storage
2-8°C
Complexity
693
Covalently-Bonded Unit Count
2
Defined Atom Stereocenter Count
2
Exact Mass
620.084g/mol
H-Bond Acceptor
4
H-Bond Donor
1
Heavy Atom Count
37
Monoisotopic Mass
620.084g/mol
Rotatable Bond Count
8
Topological Polar Surface Area
55.6A^2
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