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Tetrahexylammonium hydrogensulfate - for ion chromatography,≥99.0%(T), high purity , CAS No.32503-34-7
Basic Description
Synonyms
CS-0137573 | SY106363 | T3495 | AKOS025295146 | 1-Hexanaminium, N,N,N-trihexyl-, sulfate (1:1) | J-018764 | Tetrahexylammonium hydrogensulphate | Tetrahexylammonium hydrogensulfate | tetra-n-hexyl-ammonium hydrogensulphate | hydrogen sulfate;tetrahexylaza
Specifications & Purity
for ion pair chromatography, ≥99%(T)
Storage Temp
Argon charged
Shipped In
Normal
Grade
for ion pair chromatography
Product Description
Lipophilic phase transfer catalyst. Most efficient catalyst in ruthenium-catalyzed reactions.
Taxonomic Classification
Kingdom
Organic compounds
Superclass
Organic acids and derivatives
Class
Organic sulfuric acids and derivatives
Subclass
Not available
Intermediate Tree Nodes
Not available
Direct Parent
Organic sulfuric acids and derivatives
Alternative Parents
Tetraalkylammonium salts Organic salts Organic oxides Hydrocarbon derivatives Amines Organic cations
Molecular Framework
Aliphatic acyclic compounds
Substituents
Tetraalkylammonium salt - Quaternary ammonium salt - Organic sulfuric acid or derivatives - Organic nitrogen compound - Organic oxygen compound - Organic oxide - Hydrocarbon derivative - Organic salt - Organonitrogen compound - Amine - Organic cation - Aliphatic acyclic compound
Description
This compound belongs to the class of organic compounds known as organic sulfuric acids and derivatives. These are organic compounds containing the sulfuric acid or a derivative thereof.
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.
Names and Identifiers
IUPAC Name
hydrogen sulfate;tetrahexylazanium
INCHI
InChI=1S/C24H52N.H2O4S/c1-5-9-13-17-21-25(22-18-14-10-6-2,23-19-15-11-7-3)24-20-16-12-8-4;1-5(2,3)4/h5-24H2,1-4H3;(H2,1,2,3,4)/q+1;/p-1
InChIKey
RULHPTADXJPDSN-UHFFFAOYSA-M
Smiles
CCCCCC[N+](CCCCCC)(CCCCCC)CCCCCC.OS(=O)(=O)[O-]
Isomeric SMILES
CCCCCC[N+](CCCCCC)(CCCCCC)CCCCCC.OS(=O)(=O)[O-]
WGK Germany
3
PubChem CID
11015848
Molecular Weight
451.75
Beilstein
4629729
Certificates（CoA,COO,BSE/TSE and Analysis Chart)
Chemical and Physical Properties
Solubility
Soluble in water (partly).,
Sensitivity
Moisture sensitive
Melt Point(°C)
96-103°C
Molecular Weight
451.700 g/mol
XLogP3
Hydrogen Bond Donor Count
1
Hydrogen Bond Acceptor Count
4
Rotatable Bond Count
20
Exact Mass
451.37 Da
Monoisotopic Mass
451.37 Da
Topological Polar Surface Area
85.800 Ų
Heavy Atom Count
30
Formal Charge
0
Complexity
271.000
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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G2203395