Tris(pentafluorofenil)borano - ≥97% , CAS No.1109-15-5

CAS: 1109-15-5 Cat. No.: T109495 Fórmula: C₁₈BF₁₅ Peso molecular: 511.98 Beilstein Registry Number: 2931347 Número CE: 414-000-7 PubChem CID: 582056

GRADE & PURITY ≥97%

Synonyms

tris(pentafluorofenil)-borano | Tris(perfluorofenil)borano | Perfluorotrifenilborão | Tris(2,3,4,5,6-pentafluorofenil)borano

Storage

Armazenar a -20°C, carregado com árgon

Shipped In

Arca de gelo + almofadas de gelo

Visão geral

O B(C6F5)3 é um ácido de Lewis, mais forte do que a molécula inorgânica de origem BF3. Ao contrário dos ácidos de Lewis proeminentes, os pentafluoretos dos elementos mais pesados do grupo 15, o B(C6F5)3 não tem propriedades oxidantes. O B(C6F5)3 forma aductos com bases de Lewis neutras e mais fracas. O B(C6F5)3 tem a capacidade de aceitar facilmente ligandos aniónicos ligados a metais.

Aplicações：

Um reagente versátil amplamente utilizado na preparação de d0 areno e outros complexos organometálicos úteis como catalisadores de polimerização.

Utilizado com tri-terc-butilfosfina (570958) para estudar a clivagem heterolítica do di-hidrogénio à temperatura ambiente e à pressão de uma atmosfera

Specifications

Sinónimos

tris(pentafluorofenil)-borano | Tris(perfluorofenil)borano | Perfluorotrifenilborão | Tris(2,3,4,5,6-pentafluorofenil)borano

Especificações e pureza

≥97%

Condições de armazenamento de armazenamento

Armazenar a -20°C, carregado com árgon

Enviado em

Arca de gelo + almofadas de gelo

Pureza

≥97%

Nomes e identificadores

• Pubchem Sid: 508811406
• Pubchem Sid Url: https://pubchem.ncbi.nlm.nih.gov/substance/508811406
• Sorrisos canónicos: B(C1=C(C(=C(C(=C1F)F)F)F)F)(C2=C(C(=C(C(=C2F)F)F)F)F)C3=C(C(=C(C(=C3F)F)F)F)F
• IUPAC Name: tris(2,3,4,5,6-pentafluorophenyl)borane
• InChIKey: OBAJXDYVZBHCGT-UHFFFAOYSA-N
• INCHI: 1S/C18BF15/c20-4-1(5(21)11(27)16(32)10(4)26)19(2-6(22)12(28)17(33)13(29)7(2)23)3-8(24)14(30)18(34)15(31)9(3)25
• SMILES isoméricas: B(C1=C(C(=C(C(=C1F)F)F)F)F)(C2=C(C(=C(C(=C2F)F)F)F)F)C3=C(C(=C(C(=C3F)F)F)F)F
• WGK Alemanha: 3
• PubChem CID: 582056
• Peso molecular: 511.98
• Beilstein: 2931347
• Reaxy-Rn: 2931347

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: Fluorobenzenes
• Alternative Parents: Aryl fluorides Organic metalloid salts Organofluorides Organoboron compounds Hydrocarbon derivatives
• Molecular Framework: Aromatic homomonocyclic compounds
• Substituents: Fluorobenzene - Aryl halide - Aryl fluoride - Organic metalloid salt - Hydrocarbon derivative - Organic salt - Organofluoride - Organoboron compound - Organohalogen compound - Aromatic homomonocyclic compound
• Descrição: This compound belongs to the class of organic compounds known as fluorobenzenes. These are compounds containing one or more fluorine atoms 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

• Solubilidade: Soluble in hexane, chloroform, dichloromethane, toluene, and polar solvents
• Sensibilidade: heat sensitive，Moisture sensitive
• Ponto de fusão (°C): 126-130°C
• Peso molecular: 512.000 g/mol
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 15
• Rotatable Bond Count: 3
• Exact Mass: 511.985 Da
• Monoisotopic Mass: 511.985 Da
• Topological Polar Surface Area: 0.000 Ų
• Heavy Atom Count: 34
• Formal Charge: 0
• Complexity: 566.000
• 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

Referências

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