2-Chlorophenylzinc iodide solution - 0.5M in THF , CAS No.148651-35-8

CAS: 148651-35-8 Cat. No.: C465891 Fórmula: ClC₆H₄ZnI Peso molecular: 303.84 PubChem CID: 4185004

GRADE & PURITY 0.5M in THF

Storage

Store at 2-8°C,Argon charged

Shipped In

Wet ice

Visão geral

Description

2-Chlorophenylzinc iodide is an organozinc compound, which can be used as a reactant in Negishi cross-coupling reaction to construct carbon-carbon bonds by reacting with organic halides using nickel or palladium catalysts.It can also be utilized as a reactant to prepare:Arylmethanes via rhodium-catalyzed cross-coupling reaction with methyl halides.(2-chlorobenzyl)trimethylsilane by Rh-catalyzed cross-coupling reaction with (iodomethyl)trimethylsilane.Dichloro biphenyl by palladium catalyzed oxidative homocoupling reaction usingN-chlorosuccinimide (NCS) or O2as the oxidant.

Specifications

Especificações e pureza

0.5M in THF

Informações legais

Rieke® Metals, Inc. 产品 ®Rieke Metals, Inc. 的注册商标Rieke is a registered trademark of Rieke Metals, Inc.

Condições de armazenamento de armazenamento

Store at 2-8°C,Argon charged

Enviado em

Wet ice

Este produto requer transporte de cadeia fria. Serviços terrestres e outros serviços econômicos não estão disponíveis.

Nomes e identificadores

• Sorrisos canónicos: C1=CC=C([C-]=C1)Cl.[Zn+]I
• IUPAC Name: chlorobenzene;iodozinc(1+)
• InChIKey: NNTCIUUTIPRDJR-UHFFFAOYSA-M
• INCHI: 1S/C6H4Cl.HI.Zn/c7-6-4-2-1-3-5-6;;/h1-4H;1H;/q-1;;+2/p-1
• SMILES isoméricas: C1=CC=C([C-]=C1)Cl.[Zn+]I
• PubChem CID: 4185004
• Número UN: 2056
• Peso molecular: 303.84

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Benzenoids
    • Classe Benzene and substituted derivatives
      • Subclass Halobenzenes

• Kingdom: Organic compounds
• Superclass: Benzenoids
• Classe: Benzene and substituted derivatives
• Subclass: Halobenzenes
• Intermediate Tree Nodes: Not available
• Direct Parent: Chlorobenzenes
• Alternative Parents: Aryl chlorides Organic transition metal salts Organic metal halides Organochlorides Hydrocarbon derivatives Organic cations
• Molecular Framework: Aromatic homomonocyclic compounds
• Substituents: Chlorobenzene - Aryl halide - Aryl chloride - Organic metal halide - Organic metal salt - Organic transition metal salt - Hydrocarbon derivative - Organic salt - Organochloride - Organohalogen compound - Organic cation - Aromatic homomonocyclic compound
• Descrição: This compound belongs to the class of organic compounds known as chlorobenzenes. These are compounds containing one or more chlorine atoms attached to a benzene moiety.
• 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

Propriedades químicas e físicas

• Sensibilidade: Heat sensitive
• Ponto de inflamação (°F): 1.0 °F - closed cup
• Ponto de inflamação (°C): -17.22 °C - closed cup
• Peso molecular: 303.800 g/mol
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 0
• Exact Mass: 301.834 Da
• Monoisotopic Mass: 301.834 Da
• Topological Polar Surface Area: 0.000 Ų
• Heavy Atom Count: 9
• Formal Charge: 0
• Complexity: 149.000
• 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

XLogP3

Perguntas frequentes

How should this product be stored?

Store at 2–8 °C under argon. It is supplied under an argon blanket; reseal under inert gas after each use.

How is this product shipped?

This product ships chilled on wet ice. Unpack on arrival and transfer it to the storage condition stated above.

What are the CAS number, molecular formula and molecular weight?

The CAS Number is 148651-35-8, the molecular formula is C6H4ClIZn, and the molecular weight is 303.84 g/mol. InChIKey NNTCIUUTIPRDJR-UHFFFAOYSA-M.

What documentation is provided?

Available product documentation, including Certificates of Analysis (COA), Safety Data Sheets (SDS), and specification sheets, is shown in the product document area. Document availability and access follow the current site policy.