1,2-Bis(phenylsulfinyl)ethane Palladium(II) Diacetate - ≥97% , CAS No.858971-43-4

CAS: 858971-43-4 Cat. No.: B488782 Peso molecular: 502.9 Número EC: 679-536-8

GRADE & PURITY ≥97%

Synonyms

2-(benzenesulfinyl)ethylsulfinylbenzene;palladium(2+);diacetate | B3292 | 1,2-Bis(phenylsulfinyl)ethane Palladium(II) Diacetate | 1,2-Bis(phenylsulfinyl)ethane-palladium diacetate | AKOS015837577 | White Catalyst | A863394 | MFCD09842752

Storage

Store at -20°C,Argon charged

Shipped In

Ice chest + Ice pads

Descripción general

Description

We are committed to bringing you Greener Alternative Products, which adhere to one or more of The 12 Principles of Greener Chemistry. This product has been enhanced for catalytic efficiency. Find detailshere.Macrolactonization via Hydrocarbon OxidationCatalyst for allylic C-H oxidation, useful for preparation of branched allylic esters, macrocycles, and amino alcohol derivatives.White Catalyst: A Catalyst for Allylic C–H Oxidation and Amination

Product Application:

Catalyst for allylic C-H oxidation, useful for preparation of branched allylic esters, macrocycles, and amino alcohol derivatives.

Specifications

Sinónimos

2-(benzenesulfinyl)ethylsulfinylbenzene;palladium(2+);diacetate | B3292 | 1, 2-Bis(phenylsulfinyl)ethane Palladium(II) Diacetate | 1, 2-Bis(phenylsulfinyl)ethane-palladium diacetate | AKOS015837577 | White Catalyst | A863394 | MFCD09842752

Especificaciones y pureza

≥97%

Condiciones de almacenamiento de almacenamiento

Store at -20°C, Argon charged

Enviado en

Ice chest + Ice pads

Este producto requiere envío en cadena de frío. Los servicios terrestres y otros servicios económicos no están disponibles.

Pureza

≥97%

Nombres e identificadores

• Sonrisas canónicas: CC(=O)[O-].CC(=O)[O-].C1=CC=C(C=C1)S(=O)CCS(=O)C2=CC=CC=C2.[Pd+2]
• IUPAC Name: 2-(benzenesulfinyl)ethylsulfinylbenzene;palladium(2+);diacetate
• InChIKey: SNNYSJNYZJXIFE-UHFFFAOYSA-L
• INCHI: 1S/C14H14O2S2.2C2H4O2.Pd/c15-17(13-7-3-1-4-8-13)11-12-18(16)14-9-5-2-6-10-14;2*1-2(3)4;/h1-10H,11-12H2;2*1H3,(H,3,4);/q;;;+2/p-2
• Isómeros SMILES: CC(=O)[O-].CC(=O)[O-].C1=CC=C(C=C1)S(=O)CCS(=O)C2=CC=CC=C2.[Pd+2]
• WGK Alemania: 3
• Peso molecular: 502.9
• Reaxy-Rn: 17465335
• Reaxys-RN_link_address: https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=17465335&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Benzenoids
    • Clase Benzene and substituted derivatives
      • Subclass Phenyl sulfoxides

• Kingdom: Organic compounds
• Superclass: Benzenoids
• Clase: Benzene and substituted derivatives
• Subclass: Phenyl sulfoxides
• Intermediate Tree Nodes: Not available
• Direct Parent: Phenyl sulfoxides
• Alternative Parents: Sulfoxides Sulfinyl compounds Organic transition metal salts Monocarboxylic acids and derivatives Carboxylic acids Organic oxides Hydrocarbon derivatives Carbonyl compounds
• Molecular Framework: Not available
• Substituents: Phenyl sulfoxide - Sulfoxide - Organic transition metal salt - Sulfinyl compound - Monocarboxylic acid or derivatives - Carboxylic acid - Carboxylic acid derivative - Organic oxygen compound - Organic oxide - Hydrocarbon derivative - Organic salt - Organosulfur compound - Organooxygen compound - Carbonyl group - Aromatic homomonocyclic compound
• Descripción: This compound belongs to the class of organic compounds known as phenyl sulfoxides. These are organosulfur compounds containing a sulfoxide group substituted with a phenyl group.
• External Descriptors: Not available

Data sources

1. Djoumbou Feunang Y, Eisner R, Knox C, Chepelev L, Hastings J, Owen G, Fahy E, Steinbeck C, Subramanian S, Bolton E, Greiner R, and Wishart DS. ClassyFire: Automated Chemical Classification With A Comprehensive, Computable Taxonomy. Journal of Cheminformatics, 2016, 8:61.

DOI: 10.1186/s13321-016-0174-y

Propiedades químicas y físicas

• Solubilidad: Soluble in chloroform
• Sensibilidad: Heat sensitive;Moisture sensitive
• Peso molecular: 502.900 g/mol
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 8
• Rotatable Bond Count: 5
• Exact Mass: 501.974 Da
• Monoisotopic Mass: 501.974 Da
• Topological Polar Surface Area: 153.000 Ų
• Heavy Atom Count: 27
• Formal Charge: 0
• Complexity: 288.000
• Isotope Atom Count: 0
• Defined Atom Stereocenter Count: 0
• Undefined Atom Stereocenter Count: 2
• Defined Bond Stereocenter Count: 0
• Undefined Bond Stereocenter Count: 0
• The total count of all stereochemical bonds: 0
• Covalently-Bonded Unit Count: 4

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