Tetrabutylammonium sulfate solution - 50wt% in water , CAS No.2472-88-0

CAS: 2472-88-0 Cat. No.: T102283 Fórmula: [[CH₃(CH₂)₃]₄N]₂SO₄ Peso molecular: 580.99 Número CE: 219-593-4 PubChem CID: 11433187

GRADE & PURITY 50wt% in water

Synonyms

BP-31044 | MFCD00216632 | tetrabutylammonium monosulphate | tetrabutylammonium sulphate | tetrabutylammoniumsulfate | J-015648 | tetrabutyl ammoniumsulfat | tetrabutylazanium;sulfate | bis(tetrabutylammonium) sulfate sol. | CAA47288 | DTXSID70179454 | tet

Storage

Protected from light,Room temperature

Shipped In

Normal

Visão geral

Application：

Tetra-n-butylammonium sulfate is used as a phase transfer catalyst, neutral pH and organic intermediate. It can be used in agrochemical, pharmaceutical and dyestuff field.

Specifications

Sinónimos

BP-31044 | MFCD00216632 | tetrabutylammonium monosulphate | tetrabutylammonium sulphate | tetrabutylammoniumsulfate | J-015648 | tetrabutyl ammoniumsulfat | tetrabutylazanium;sulfate | bis(tetrabutylammonium) sulfate sol. | CAA47288 | DTXSID70179454 | tet

Especificações e pureza

50wt% in water

Condições de armazenamento de armazenamento

Protected from light,Room temperature

Enviado em

Normal

Nomes e identificadores

Pubchem Sid

488197492

Pubchem Sid Url

https://pubchem.ncbi.nlm.nih.gov/substance/488197492

Sorrisos canónicos

CCCC[N+](CCCC)(CCCC)CCCC.CCCC[N+](CCCC)(CCCC)CCCC.[O-]S(=O)(=O)[O-]

IUPAC Name

tetrabutylazanium;sulfate

InChIKey

ZXUCBXRTRRIBSO-UHFFFAOYSA-L

INCHI

1S/2C16H36N.H2O4S/c2*1-5-9-13-17(14-10-6-2,15-11-7-3)16-12-8-4;1-5(2,3)4/h2*5-16H2,1-4H3;(H2,1,2,3,4)/q2*+1;/p-2

SMILES isoméricas

CCCC[N+](CCCC)(CCCC)CCCC.CCCC[N+](CCCC)(CCCC)CCCC.[O-]S(=O)(=O)[O-]

WGK Alemanha

3

PubChem CID

11433187

Peso molecular

580.99

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Organic salts
    • Classe Organic sulfate salts

• Kingdom: Organic compounds
• Superclass: Organic salts
• Classe: Organic sulfate salts
• Subclass: Not available
• Intermediate Tree Nodes: Not available
• Direct Parent: Organic sulfate salts
• Alternative Parents: Tetraalkylammonium salts Organic sulfuric acids and derivatives Organic oxides Hydrocarbon derivatives Amines Organic cations
• Molecular Framework: Not available
• Substituents: Organic sulfate salt - Tetraalkylammonium salt - Quaternary ammonium salt - Organic sulfuric acid or derivatives - Organic nitrogen compound - Organic oxygen compound - Organic oxide - Hydrocarbon derivative - Organonitrogen compound - Amine - Organic cation - Aliphatic acyclic compound
• Descrição: This compound belongs to the class of organic compounds known as organic sulfate salts. These are organic compounds containing a sulfate ion.
• 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: Fully miscible.
• Sensibilidade: Light sensitive; Moisture sensitive
• Índice de refração: 1.417
• Ponto de ebulição (°C): 84°C
• Peso molecular: 581.000 g/mol
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 24
• Exact Mass: 580.521 Da
• Monoisotopic Mass: 580.521 Da
• Topological Polar Surface Area: 88.600 Ų
• Heavy Atom Count: 39
• Formal Charge: 0
• Complexity: 178.000
• 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: 3

XLogP3