Cyclohexylzinc bromide solution - 0.5M in THF , CAS No.7565-57-3

CAS: 7565-57-3 Cat. No.: C465981 Peso molecular: 228.44 Número EC: 628-377-2

GRADE & PURITY 0.5M in THF

Synonyms

cyclohexylzinc bromide | bromozinc(1+);cyclohexane | AKOS015916156 | Cyclohexylzinc bromide, 0.50 M in THF | MFCD00671993 | cyclohexylzinc(II) bromide | Cyclohexylzinc bromide 0.5 M in Tetrahydrofuran | Cyclohexylzinc bromide, 0.5M in THF, packaged under

Storage

Store at 2-8°C

Shipped In

Wet ice

Descripción general

Description

Cyclohexylzinc bromide is an organozinc reagent, generally used in Negishi coupling. Examples include the cross-coupling of alkylzinc halides with aryl/heteroaryl halides using Pd-PEPPSI-IPent and nickel-catalyzed synthesis of 4-substituted coumarins.It can react with the SO2surrogate, 1,4-diazabicyclo[2.2.2]octane bis(sulfur dioxide) adduct (DABSO) to afford zinc sulfinate salts which can be alkylated to synthesize various useful sulfones.

Specifications

Sinónimos

cyclohexylzinc bromide | bromozinc(1+);cyclohexane | AKOS015916156 | Cyclohexylzinc bromide, 0.50 M in THF | MFCD00671993 | cyclohexylzinc(II) bromide | Cyclohexylzinc bromide 0.5 M in Tetrahydrofuran | Cyclohexylzinc bromide, 0.5M in THF, packaged under

Especificaciones y pureza

0.5M in THF

Información jurídica

Rieke® Metals, Inc. 制造。®Rieke Metals, Inc. 的注册商标。

Condiciones de almacenamiento de almacenamiento

Store at 2-8°C

Enviado en

Wet ice

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

Nombres e identificadores

• Sonrisas canónicas: C1CC[CH-]CC1.[Zn+]Br
• IUPAC Name: bromozinc(1+);cyclohexane
• InChIKey: PVURAUIMVICLOH-UHFFFAOYSA-M
• INCHI: 1S/C6H11.BrH.Zn/c1-2-4-6-5-3-1;;/h1H,2-6H2;1H;/q-1;;+2/p-1
• Isómeros SMILES: C1CC[CH-]CC1.[Zn+]Br
• Peso molecular: 228.44
• Reaxy-Rn: 4738485
• Reaxys-RN_link_address: https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=4738485&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Organic salts
    • Clase Organic metal salts
      • Subclass Organic metal halides

• Kingdom: Organic compounds
• Superclass: Organic salts
• Clase: Organic metal salts
• Subclass: Organic metal halides
• Intermediate Tree Nodes: Not available
• Direct Parent: Organic metal halides
• Alternative Parents: Organic transition metal salts Organic metal bromide salts Organic bromide salts Hydrocarbon derivatives Organic cations
• Molecular Framework: Aliphatic homomonocyclic compounds
• Substituents: Organic metal halide - Organic metal bromide salt - Organic transition metal salt - Hydrocarbon derivative - Organic bromide salt - Organic cation - Aliphatic homomonocyclic compound
• Descripción: This compound belongs to the class of organic compounds known as organic metal halides. These are organic compounds containing metals and halogens. Some are ionic while others are covalently bonded.
• 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

• Punto de ebullición (°C): 66° C
• Peso molecular: 228.400 g/mol
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 0
• Exact Mass: 225.934 Da
• Monoisotopic Mass: 225.934 Da
• Topological Polar Surface Area: 0.000 Ų
• Heavy Atom Count: 8
• Formal Charge: 0
• Complexity: 35.500
• Isotope Atom Count: 0
• Defined Atom Stereocenter Count: 0
• Undefined Atom Stereocenter Count: 0
• Defined Bond Stereocenter Count: 0
• Undefined Bond Stereocenter Count: 0
• The total count of all stereochemical bonds: 0
• Covalently-Bonded Unit Count: 2

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