Trimethyltin chloride solution - 1.0 M in hexanes , CAS No.1066-45-1

CAS: 1066-45-1 Cat. No.: T431335 Fórmula: C₃H₉ClSn Peso molecular: 199.27 Beilstein Registry Number: 3535111 Número CE: 213-917-8

GRAU & PUREZA 1.0 M in hexanes

Synonyms

Chlorotrimethyltin | Trimethylchlorotin | TRIMETHYLTIN CHLORIDE | Chlorotrimethylstannane | Trimethylstannyl chloride

Storage

Room temperature

Visão geral

Trimethyltin chloride solution (1.0 M in hexanes) can be used as a reagent in the synthesis of conjugated polymers based on isoindigo as acceptor and syn - or anti -benzo[1,2- b :5,4- b ′]difuran (BDF) as a donor by Stille cross-coupling reaction. It can further be used for the investigation of optical, electrochemical and photovoltaic properties.

Especificações

Sinónimos

Chlorotrimethyltin | Trimethylchlorotin | TRIMETHYLTIN CHLORIDE | Chlorotrimethylstannane | Trimethylstannyl chloride

Especificações e pureza

1.0 M in hexanes

Condições de armazenamento de armazenamento

Room temperature

Nomes e identificadores

Sorrisos canónicos

C[Sn](C)(C)Cl

IUPAC Name

chloro(trimethyl)stannane

InChIKey

KWTSZCJMWHGPOS-UHFFFAOYSA-M

INCHI

1S/3CH3.ClH.Sn/h3*1H3;1H;/q;;;;+1/p-1

SMILES isoméricas

C[Sn](C)(C)Cl

WGK Alemanha

2

RTECS

WH6850000

Número UN

3146

Grupo de embalagem

I

Peso molecular

199.27

Beilstein

3535111

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Organic salts
    • Classe Organic metal salts
      • Subclass Organic post-transition metal salts
        • Level5 Organic tin salts
          • Level6 Triorganotin halide salts

• Kingdom: Organic compounds
• Superclass: Organic salts
• Classe: Organic metal salts
• Subclass: Organic post-transition metal salts
• Intermediate Tree Nodes: Organic tin salts
• Direct Parent: Triorganotin halide salts
• Alternative Parents: Trialkyltins Metal alkyl halides Hydrocarbon derivatives
• Molecular Framework: Aliphatic acyclic compounds
• Substituents: Triorganotin halide salt - Trialkyltin - Metal alkyl halide - Hydrocarbon derivative - Organotin compound - Organometallic compound - Organic post-transition metal moeity - Aliphatic acyclic compound
• Descrição: This compound belongs to the class of organic compounds known as triorganotin halide salts. These are organic compounds containing a tin atom bonded to three carbon atoms and a halogen atom.
• 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

• Ponto de inflamação (°F): -9.4 °
• Ponto de inflamação (°C): 97℃
• Ponto de ebulição (°C): 148°C
• Ponto de fusão (°C): 37-39°C
• Peso molecular: 199.270 g/mol
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 0
• Rotatable Bond Count: 0
• Exact Mass: 199.941 Da
• Monoisotopic Mass: 199.941 Da
• Topological Polar Surface Area: 0.000 Ų
• Heavy Atom Count: 5
• Formal Charge: 0
• Complexity: 28.400
• 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