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Chloronitrosyl[N,N'-bis(3,5-di-tert-butylsalicylidene)-1,1,2,2-tetramethylethylenediaminato]ruthenium(IV)

Chloronitrosyl[N,N'-bis(3,5-di-tert-butylsalicylidene)-1,1,2,2-tetramethylethylenediaminato]ruthenium(IV)

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Catalog Number

ACM386761713-1

Product Name

Structure

CAS

386761-71-3

Product Overview
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Synonyms

Chlororuthenium(1+);2,4-ditert-butyl-6-[[3-[(3,5-ditert-butyl-2-hydroxyphenyl)methylideneamino]-2,3-dimethylbutan-2-yl]iminomethyl]phenol;nitroxyl anion

IUPAC Name

2,4-ditert-butyl-6-[[3-[(3,5-ditert-butyl-2-oxidophenyl)methylideneamino]-2,3-dimethylbutan-2-yl]iminomethyl]phenolate;nitroxyl anion;ruthenium(4+);chloride;

Molecular Weight

715.4

Molecular Formula

C36H56ClN3O3Ru

Canonical SMILES

CC(C)(C)C1=CC(=C(C(=C1)C(C)(C)C)O)C=NC(C)(C)C(C)(C)N=CC2=C(C(=CC(=C2)C(C)(C)C)C(C)(C)C)O.[N-]=O.Cl[Ru+]

InChI

InChI=1S/C36H56N2O2.ClH.NO.Ru/c1-31(2,3)25-17-23(29(39)27(19-25)33(7,8)9)21-37-35(13,14)36(15,16)38-22-24-18-26(32(4,5)6)20-28(30(24)40)34(10,11)12;1-2;/h17-22,39-40H,1-16H3;1H;/q;-1;+2/p-1

InChI Key

JLSGLGOKJIQCOY-UHFFFAOYSA-M

Storage

Refrigerator

Complexity

816

Covalently-Bonded Unit Count

Exact Mass

715.305361

H-Bond Acceptor

Heavy Atom Count

Monoisotopic Mass

715.305361

Rotatable Bond Count

Topological Polar Surface Area

83.2 Å²

January 20, 2023

Work good in oxidizing reaction

In the catalytic reaction of mixed alcohols, chloronitrosyl[N,N'-bis(3,5-di-tert-butylsalicylidene)-1,1,2,2-tetramethylethylenediaminato]ruthenium(IV) has high selectivity and can selectively catalyze the oxidation of primary alcohols.

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