| Catalog Number |
ACM865488444-1 |
| CAS |
865488-44-4 |
| Synonyms |
Chloro(mesitylene)[(1S,2S)-(+)-2-amino-1,2-diphenylethyl(methylsulfonylamido)]ruthenium(II) |
| IUPAC Name |
[(1S,2S)-2-amino-1,2-diphenylethyl]-methylsulfonylazanide;chlororuthenium(1+);1,3,5-trimethylbenzene; |
| Molecular Weight |
546.1 |
| Molecular Formula |
C24H29ClN2O2RuS |
| Canonical SMILES |
CC1=CC(=CC(=C1)C)C.CS(=O)(=O)[N-]C(C1=CC=CC=C1)C(C2=CC=CC=C2)N.Cl[Ru+] |
| InChI |
InChI=1S/C15H17N2O2S.C9H12.ClH.Ru/c1-20(18,19)17-15(13-10-6-3-7-11-13)14(16)12-8-4-2-5-9-12;1-7-4-8(2)6-9(3)5-7;/h2-11,14-15H,16H2,1H3;4-6H,1-3H3;1H;/q-1;+2/p-1/t14-,15-;/m0/s1 |
| InChI Key |
IACBEXZXCYLFOG-CEHYLXJWSA-M |
| Purity |
98% |
| Appearance |
Brown powder |
| Application |
Chloro(Mesitylene)[(1S,2S)-(+)-2-aMino-1,2-diphenylethyl(Methylsulfonylamido)]ruthenium(II) RuCl(Mesitylene)[(S,S)-MsDpen] is the catalyst used for producing optically active aliphatic fluoroalcohols. |
| Complexity |
446 |
| Covalently-Bonded Unit Count |
3 |
| Defined Atom Stereocenter Count |
2 |
| Exact Mass |
546.068167 |
| Heavy Atom Count |
31 |
| Hydrogen Bond Acceptor Count |
4 |
| Hydrogen Bond Donor Count |
1 |
| Isomeric SMILES |
CC1=CC(=CC(=C1)C)C.CS(=O)(=O)[N-][C@@H](C1=CC=CC=C1)[C@H](C2=CC=CC=C2)N.Cl[Ru+] |
| Monoisotopic Mass |
546.068167 |
| Rotatable Bond Count |
5 |
| Topological Polar Surface Area |
69.5 Ų |
