Benzylzinc bromide solution - 0.5M in THF , CAS No.62673-31-8

CAS: 62673-31-8 Cat. No.: B465975 Formula: C₇H₇BrZn Peso molecolare: 236.42 Numero EC: 627-093-6

GRADE & PURITY 0.5M in THF

Synonyms

benzylzinc bromide | SCHEMBL17596168 | Benzylzinc bromide, 0.5M in THF, packaged under Argon in resealable ChemSeal bottles | Benzylzinc bromide 0.5 M in Tetrahydrofuran | AKOS016017868 | Benzylzinc bromide, 0.50 M in THF | MFCD00671803 | bromozinc(1+);me

Storage

Store at 2-8°C,Argon charged

Shipped In

Wet ice

Panoramica

Description

Benzylzinc bromide solution can be used as a nucleophile for the Mannich-type synthesis of 1,2-diarylethylpiperazines. It can also undergo C−C cross coupling reactions with aryl halides.

Specifications

Sinonimi

benzylzinc bromide | SCHEMBL17596168 | Benzylzinc bromide, 0.5M in THF, packaged under Argon in resealable ChemSeal bottles | Benzylzinc bromide 0.5 M in Tetrahydrofuran | AKOS016017868 | Benzylzinc bromide, 0.50 M in THF | MFCD00671803 | bromozinc(1+);me

Specifiche e purezza

0.5M in THF

Condizioni di conservazione di stoccaggio

Store at 2-8°C,Argon charged

Spedito in

Wet ice

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Nomi e identificatori

• Pubchem Sid: 508816343
• Sorrisi canonici: [CH2-]C1=CC=CC=C1.[Zn+]Br
• IUPAC Name: bromozinc(1+);methanidylbenzene
• InChIKey: WRSWIWOVJBYZAW-UHFFFAOYSA-M
• INCHI: 1S/C7H7.BrH.Zn/c1-7-5-3-2-4-6-7;;/h2-6H,1H2;1H;/q-1;;+2/p-1
• Isomeri SMILES: [CH2-]C1=CC=CC=C1.[Zn+]Br
• Numero UN: 3399
• Gruppo di imballaggio: II
• Peso molecolare: 236.42
• Reaxy-Rn: 4243556
• Reaxys-RN_link_address: https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=4243556&ln=

Taxonomic Classification

Taxonomy Tree

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

• Kingdom: Organic compounds
• Superclass: Benzenoids
• Classe: Benzene and substituted derivatives
• Subclass: Not available
• Intermediate Tree Nodes: Not available
• Direct Parent: Benzene and substituted derivatives
• Alternative Parents: Organic transition metal salts Organic metal halides Organic metal bromide salts Organic bromide salts Hydrocarbon derivatives Organic cations
• Molecular Framework: Aromatic homomonocyclic compounds
• Substituents: Monocyclic benzene moiety - Organic metal halide - Organic metal bromide salt - Organic metal salt - Organic transition metal salt - Hydrocarbon derivative - Organic bromide salt - Organic salt - Organic cation - Aromatic homomonocyclic compound
• Descrizione: This compound belongs to the class of organic compounds known as benzene and substituted derivatives. These are aromatic compounds containing one monocyclic ring system consisting of benzene.
• 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

Proprietà chimiche e fisiche

• Sensibilità: Air sensitive；Hygroscopic
• Punto di infiammabilità (°F): 1.0°F
• Punto di infiammabilità (°C): -17.22°C
• Punto di ebollizione (°C): 68.3° C at 760 mmHg (Predicted)
• Peso molecolare: 236.400 g/mol
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 0
• Exact Mass: 233.902 Da
• Monoisotopic Mass: 233.902 Da
• Topological Polar Surface Area: 0.000 Ų
• Heavy Atom Count: 9
• Formal Charge: 0
• Complexity: 50.900
• 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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