Tri-tert-butylphosphonium Tetraphenylborate - ≥98% , CAS No.131322-08-2

CAS: 131322-08-2 Cat. No.: T162778 Peso molecular: 522.56 Número EC: 603-474-2 PubChem CID: 23136663

GRADE & PURITY ≥98%

Synonyms

T2258 | MFCD08276434 | SCHEMBL701137 | Tri-tert-butyl phosphonium tetraphenyl borate | Tri-tert-butylphosphanium tetraphenylborate(1-) | AKOS015911602 | Tri-tert-butylphosphoniumTetraphenylborate | T71708 | Tri-tert-butylphosphonium Tetraphenylborate | QW

Storage

Argon charged,Room temperature

Shipped In

Normal

Specifications

Sinónimos

T2258 | MFCD08276434 | SCHEMBL701137 | Tri-tert-butyl phosphonium tetraphenyl borate | Tri-tert-butylphosphanium tetraphenylborate(1-) | AKOS015911602 | Tri-tert-butylphosphoniumTetraphenylborate | T71708 | Tri-tert-butylphosphonium Tetraphenylborate | QW

Especificaciones y pureza

≥98%

Condiciones de almacenamiento de almacenamiento

Argon charged, Room temperature

Enviado en

Normal

Pureza

≥98%

Nombres e identificadores

• Pubchem Sid: 488200289
• Pubchem Sid Url: https://pubchem.ncbi.nlm.nih.gov/substance/488200289
• Sonrisas canónicas: [B-](C1=CC=CC=C1)(C2=CC=CC=C2)(C3=CC=CC=C3)C4=CC=CC=C4.CC(C)(C)[PH+](C(C)(C)C)C(C)(C)C
• IUPAC Name: tetraphenylboranuide;tritert-butylphosphanium
• InChIKey: QWISVPBFGJWCBS-UHFFFAOYSA-O
• INCHI: 1S/C24H20B.C12H27P/c1-5-13-21(14-6-1)25(22-15-7-2-8-16-22,23-17-9-3-10-18-23)24-19-11-4-12-20-24;1-10(2,3)13(11(4,5)6)12(7,8)9/h1-20H;1-9H3/q-1;/p+1
• Isómeros SMILES: [B-](C1=CC=CC=C1)(C2=CC=CC=C2)(C3=CC=CC=C3)C4=CC=CC=C4.CC(C)(C)[PH+](C(C)(C)C)C(C)(C)C
• PubChem CID: 23136663
• Peso molecular: 522.56
• Reaxy-Rn: 8819356

Taxonomic Classification

Taxonomy Tree

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

• Kingdom: Organic compounds
• Superclass: Benzenoids
• Clase: Benzene and substituted derivatives
• Subclass: Not available
• Intermediate Tree Nodes: Not available
• Direct Parent: Benzene and substituted derivatives
• Alternative Parents: Organophosphorus compounds Organometalloid compounds Hydrocarbon derivatives Organic cations
• Molecular Framework: Not available
• Substituents: Monocyclic benzene moiety - Hydrocarbon derivative - Organophosphorus compound - Organic metalloid moeity - Organic cation - Aromatic homomonocyclic compound
• Descripción: 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

Propiedades químicas y físicas

• Sensibilidad: Air Sensitive
• Peso molecular: 522.600 g/mol
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 7
• Exact Mass: 522.359 Da
• Monoisotopic Mass: 522.359 Da
• Topological Polar Surface Area: 0.000 Ų
• Heavy Atom Count: 38
• Formal Charge: 0
• Complexity: 429.000
• 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

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