Triphenylsulfonium perfluoro-1-butanesufonate - ≥99% , CAS No.144317-44-2

CAS: 144317-44-2 Cat. No.: T167308 Peso molecular: 562.47 Número EC: 477-300-7 PubChem CID: 16216936

GRADE & PURITY ≥99%

Synonyms

Triphenylsulfonium nonaflate|144317-44-2|Triphenylsulphonium nonaflate|Sulfonium, triphenyl-, 1,1,2,2,3,3,4,4,4-nonafluoro-1-butanesulfonate (1:1)|Triphenylsulfonium perfluoro-1-butanesufonate|1,1,2,2,3,3,4,4,4-nonafluorobutane-1-sulfonate;triphenylsulfan

Storage

Store at 2-8°C,Protected from light,Argon charged

Shipped In

Wet ice

Specifications

Sinónimos

Triphenylsulfonium nonaflate | 144317-44-2 | Triphenylsulphonium nonaflate | Sulfonium, triphenyl-, 1, 1, 2, 2, 3, 3, 4, 4, 4-nonafluoro-1-butanesulfonate (1:1) | Triphenylsulfonium perfluoro-1-butanesufonate | 1, 1, 2, 2, 3, 3, 4, 4, 4-nonafluorobutane-1-sulfonate;triphenylsulfan

Especificaciones y pureza

≥99%

Condiciones de almacenamiento de almacenamiento

Store at 2-8°C, Protected from light, Argon charged

Enviado en

Wet ice

Este producto requiere envío en cadena de frío. Los servicios terrestres y otros servicios económicos no están disponibles.

Pureza

≥99%

Nombres e identificadores

• Pubchem Sid: 504768248
• Pubchem Sid Url: https://pubchem.ncbi.nlm.nih.gov/substance/504768248
• Sonrisas canónicas: C1=CC=C(C=C1)[S+](C2=CC=CC=C2)C3=CC=CC=C3.C(C(C(F)(F)S(=O)(=O)[O-])(F)F)(C(F)(F)F)(F)F
• IUPAC Name: 1,1,2,2,3,3,4,4,4-nonafluorobutane-1-sulfonate;triphenylsulfanium
• InChIKey: VLLPVDKADBYKLM-UHFFFAOYSA-M
• INCHI: 1S/C18H15S.C4HF9O3S/c1-4-10-16(11-5-1)19(17-12-6-2-7-13-17)18-14-8-3-9-15-18;5-1(6,3(9,10)11)2(7,8)4(12,13)17(14,15)16/h1-15H;(H,14,15,16)/q+1;/p-1
• Isómeros SMILES: C1=CC=C(C=C1)[S+](C2=CC=CC=C2)C3=CC=CC=C3.C(C(C(F)(F)S(=O)(=O)[O-])(F)F)(C(F)(F)F)(F)F
• PubChem CID: 16216936
• Peso molecular: 562.47

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Organohalogen compounds
    • Clase Alkyl halides
      • Subclass Alkyl fluorides

• Kingdom: Organic compounds
• Superclass: Organohalogen compounds
• Clase: Alkyl halides
• Subclass: Alkyl fluorides
• Intermediate Tree Nodes: Not available
• Direct Parent: Perfluoroalkyl sulfonic acid and derivatives
• Alternative Parents: Benzene and substituted derivatives Sulfonyls Organosulfonic acids Alkanesulfonic acids Organofluorides Organic salts Organic oxides Hydrocarbon derivatives
• Molecular Framework: Not available
• Substituents: Perfluoroalkyl sulfonic acid or derivatives - Benzenoid - Monocyclic benzene moiety - Alkanesulfonic acid - Sulfonyl - Organosulfonic acid - Organosulfonic acid or derivatives - Organic sulfonic acid or derivatives - Organic oxygen compound - Organic oxide - Hydrocarbon derivative - Organic salt - Organosulfur compound - Organofluoride - Aromatic homomonocyclic compound
• Descripción: This compound belongs to the class of organic compounds known as perfluoroalkyl sulfonic acid and derivatives. These are organic compounds containing an alkyl chain attached to the sulfur of a sulfonic acid group (or a derivative thereof), where all hydrogens of the alkyl chain are replaced by fluorine atoms.
• 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: Light and moisture sensitive
• Punto de fusión (°C): 86 °C
• Peso molecular: 562.500 g/mol
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 12
• Rotatable Bond Count: 5
• Exact Mass: 562.032 Da
• Monoisotopic Mass: 562.032 Da
• Topological Polar Surface Area: 66.600 Ų
• Heavy Atom Count: 36
• Formal Charge: 0
• Complexity: 576.000
• 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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