[(3-Bromophenyl)ethynyl]trimethylsilane - ≥95% , CAS No.3989-13-7

CAS: 3989-13-7 Cat. No.: B405212 Fórmula: C₁₁H₁₃BrSi Peso molecular: 253.21 Número CE: 878-379-4

GRADE & PURITY ≥95%

Synonyms

3-(trimethylsilylethynyl)bromobenzene | [2-(3-BROMOPHENYL)ETHYNYL]TRIMETHYLSILANE | B5199 | SCHEMBL2795902 | 2-(3-bromophenyl)ethynyl-trimethylsilane | 2-(3-bromophenyl)ethynyl-trimethyl-silane | [(3-bromophenyl)ethynyl](trimethyl)silane | 1-Bromo-3-[2-(t

Storage

Store at 2-8°C,Argon charged

Shipped In

Wet ice

Visão geral

Product description：

(3-Bromophenylethynyl)trimethylsilane is an internal alkyne.

Application：

(3-Bromophenylethynyl)trimethylsilane may be used in the preparation of 4-(3-bromophenyl)-3-butyn-2-one.

Specifications

Sinónimos

3-(trimethylsilylethynyl)bromobenzene | [2-(3-BROMOPHENYL)ETHYNYL]TRIMETHYLSILANE | B5199 | SCHEMBL2795902 | 2-(3-bromophenyl)ethynyl-trimethylsilane | 2-(3-bromophenyl)ethynyl-trimethyl-silane | [(3-bromophenyl)ethynyl](trimethyl)silane | 1-Bromo-3-[2-(t

Especificações e pureza

≥95%

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.

Pureza

≥95%

Nomes e identificadores

• Pubchem Sid: 504762661
• Pubchem Sid Url: https://pubchem.ncbi.nlm.nih.gov/substance/504762661
• Sorrisos canónicos: C[Si](C)(C)C#CC1=CC(=CC=C1)Br
• IUPAC Name: 2-(3-bromophenyl)ethynyl-trimethylsilane
• InChIKey: BXXMHQYHYOTTPM-UHFFFAOYSA-N
• INCHI: 1S/C11H13BrSi/c1-13(2,3)8-7-10-5-4-6-11(12)9-10/h4-6,9H,1-3H3
• SMILES isoméricas: C[Si](C)(C)C#CC1=CC(=CC=C1)Br
• WGK Alemanha: 3
• Peso molecular: 253.21
• Reaxy-Rn: 2936640
• Reaxys-RN_link_address: https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=2936640&ln=

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: Bromobenzenes
• Alternative Parents: Aryl bromides Trialkylsilanes Organic metalloid salts Organobromides Hydrocarbon derivatives
• Molecular Framework: Aromatic homomonocyclic compounds
• Substituents: Bromobenzene - Aryl halide - Aryl bromide - Trialkylsilane - Organic metalloid salt - Hydrocarbon derivative - Organosilicon compound - Alkylsilane - Organobromide - Organic metalloid moeity - Organohalogen compound - Aromatic homomonocyclic compound
• Descrição: This compound belongs to the class of organic compounds known as bromobenzenes. These are organic compounds containing a bromine atom attached to a benzene ring.
• 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: Moisture Sensitive,Heat Sensitive
• Índice de refração: 1.55
• Ponto de inflamação (°F): >230 °F
• Ponto de ebulição (°C): 95 °C/1.9 mmHg
• Peso molecular: 253.210 g/mol
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 0
• Rotatable Bond Count: 2
• Exact Mass: 251.997 Da
• Monoisotopic Mass: 251.997 Da
• Topological Polar Surface Area: 0.000 Ų
• Heavy Atom Count: 13
• Formal Charge: 0
• Complexity: 227.000
• 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: 1

XLogP3

Perguntas frequentes

What is the purity of this product?

This product is supplied at ≥95% purity (chemical assay). Lot-specific values are stated on the Certificate of Analysis.

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 3989-13-7, the molecular formula is C11H13BrSi, and the molecular weight is 253.21 g/mol. InChIKey BXXMHQYHYOTTPM-UHFFFAOYSA-N.

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.