Trihexyl(tetradecyl)phosphonium decanoate - ≥95% , CAS No.465527-65-5

CAS: 465527-65-5 Cat. No.: T282166 Peso molecular: 655.11 Número EC: 689-603-3 PubChem CID: 16213695

GRADE & PURITY ≥95%

Synonyms

SCHEMBL194214 | TRIHEXYL(TETRADECYL)PHOSPHANIUM DECANOATE | MFCD04117698 | HQIPXXNWLGIFAY-UHFFFAOYSA-M | DTXSID80584090 | trihexyl(tetradecyl)phosphonium decanoate | Trihexyltetradecylphosphonium decanoate, >=95.0% (NMR) | trihexyl(tetradecyl) phosphonium

Storage

Argon charged,Room temperature

Shipped In

Normal

Descripción general

Trihexyltetradecylphosphonium decanoate is an ionic liquid that is used as a convenient and efficient solvent for a wide range of chemical reactions due to its unique properties such as its high thermal stability and low volatility, which make it useful in a variety of organic synthesis applications.

Application：

Trihexyltetradecylphosphonium decanoate can be used as a demulsifying agent due to its unique solubility and surface-active properties. It is also used as a catalyst in Henry nitroaldol reactions.

Specifications

Sinónimos

SCHEMBL194214 | TRIHEXYL(TETRADECYL)PHOSPHANIUM DECANOATE | MFCD04117698 | HQIPXXNWLGIFAY-UHFFFAOYSA-M | DTXSID80584090 | trihexyl(tetradecyl)phosphonium decanoate | Trihexyltetradecylphosphonium decanoate, >=95.0% (NMR) | trihexyl(tetradecyl) phosphonium

Especificaciones y pureza

≥95%

Condiciones de almacenamiento de almacenamiento

Argon charged, Room temperature

Enviado en

Normal

Pureza

≥95%

Nombres e identificadores

• Sonrisas canónicas: CCCCCCCCCCCCCC[P+](CCCCCC)(CCCCCC)CCCCCC.CCCCCCCCCC(=O)[O-]
• IUPAC Name: decanoate;trihexyl(tetradecyl)phosphanium
• InChIKey: HQIPXXNWLGIFAY-UHFFFAOYSA-M
• INCHI: 1S/C32H68P.C10H20O2/c1-5-9-13-17-18-19-20-21-22-23-24-28-32-33(29-25-14-10-6-2,30-26-15-11-7-3)31-27-16-12-8-4;1-2-3-4-5-6-7-8-9-10(11)12/h5-32H2,1-4H3;2-9H2,1H3,(H,11,12)/q+1;/p-1
• Isómeros SMILES: CCCCCCCCCCCCCC[P+](CCCCCC)(CCCCCC)CCCCCC.CCCCCCCCCC(=O)[O-]
• WGK Alemania: 3
• PubChem CID: 16213695
• Peso molecular: 655.11

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Organophosphorus compounds
    • Clase Tetraalkylphosphonium compounds

• Kingdom: Organic compounds
• Superclass: Organophosphorus compounds
• Clase: Tetraalkylphosphonium compounds
• Subclass: Not available
• Intermediate Tree Nodes: Not available
• Direct Parent: Tetraalkylphosphonium compounds
• Alternative Parents: Monocarboxylic acids and derivatives Organopnictogen compounds Organic salts Hydrocarbon derivatives
• Molecular Framework: Not available
• Substituents: Tetraalkylphosphonium compound - Monocarboxylic acid or derivatives - Organopnictogen compound - Hydrocarbon derivative - Organic salt - Aliphatic acyclic compound
• Descripción: This compound belongs to the class of organic compounds known as tetraalkylphosphonium compounds. These are organophosphorus compounds that contain a tetravalent phosphorus atom substituted to four alkyl chains.
• 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: Moisture sensitive
• Peso molecular: 655.100 g/mol
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 35
• Exact Mass: 654.644 Da
• Monoisotopic Mass: 654.644 Da
• Topological Polar Surface Area: 40.100 Ų
• Heavy Atom Count: 45
• Formal Charge: 0
• Complexity: 424.000
• 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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