TES - ≥99% , CAS No.7365-44-8

CAS: 7365-44-8 Cat. No.: T105113 Fórmula: C₆H₁₅NO₆S Peso molecular: 229.25 Beilstein Registry Number: 1957061 Número CE: 230-906-3 PubChem CID: 81831

GRADE & PURITY ≥99%

Synonyms

AS-12799 | N-(tris[hydroxymethyl]methyl)-2-aminoethanesulfonic acid | TES [MI] | CD7A47B0-E486-42AF-A094-B1401F65B49B | MFCD00007532 | n-tris-(hydroxymethyl)methyl-2-aminoethanesulphonic acid | 2-{[2-hydroxy-1,1-bis(hydroxymethyl)ethyl]ammonio}ethanesulfo

Storage

Room temperature

Shipped In

Normal

Visão geral

useful pH range 6.8 - 8.2 pKa (25 °C) 7.5
A structural analog to Tris buffer.

Specifications

Sinónimos

AS-12799 | N-(tris[hydroxymethyl]methyl)-2-aminoethanesulfonic acid | TES [MI] | CD7A47B0-E486-42AF-A094-B1401F65B49B | MFCD00007532 | n-tris-(hydroxymethyl)methyl-2-aminoethanesulphonic acid | 2-{[2-hydroxy-1,1-bis(hydroxymethyl)ethyl]ammonio}ethanesulfo

Especificações e pureza

≥99%

Mecanismos bioquímicos e fisiológicos

Buffering agent. Working pH range: 6.8 - 8.2. used in a range of protein assays. Forms complexes with DNA and affects restriction enzyme kinetics.

Condições de armazenamento de armazenamento

Room temperature

Enviado em

Normal

Pureza

≥99%

Nomes e identificadores

Pubchem Sid

488186010

Pubchem Sid Url

https://pubchem.ncbi.nlm.nih.gov/substance/488186010

Sorrisos canónicos

C(CS(=O)(=O)O)NC(CO)(CO)CO

IUPAC Name

2-[[1,3-dihydroxy-2-(hydroxymethyl)propan-2-yl]amino]ethanesulfonic acid

InChIKey

JOCBASBOOFNAJA-UHFFFAOYSA-N

INCHI

1S/C6H15NO6S/c8-3-6(4-9,5-10)7-1-2-14(11,12)13/h7-10H,1-5H2,(H,11,12,13)

SMILES isoméricas

C(CS(=O)(=O)O)NC(CO)(CO)CO

WGK Alemanha

1

PubChem CID

81831

Peso molecular

229.25

Beilstein

1957061

Reaxy-Rn

1957061

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Organic acids and derivatives
    • Classe Organic sulfonic acids and derivatives
      • Subclass Organosulfonic acids and derivatives

• Kingdom: Organic compounds
• Superclass: Organic acids and derivatives
• Classe: Organic sulfonic acids and derivatives
• Subclass: Organosulfonic acids and derivatives
• Intermediate Tree Nodes: Not available
• Direct Parent: Organosulfonic acids
• Alternative Parents: Sulfonyls Alkanesulfonic acids 1,2-aminoalcohols Dialkylamines Primary alcohols Organopnictogen compounds Organic oxides Hydrocarbon derivatives
• Molecular Framework: Aliphatic acyclic compounds
• Substituents: Organosulfonic acid - Sulfonyl - Alkanesulfonic acid - 1,2-aminoalcohol - Secondary aliphatic amine - Secondary amine - Organopnictogen compound - Organic oxygen compound - Alcohol - Primary alcohol - Organosulfur compound - Organooxygen compound - Organonitrogen compound - Organic nitrogen compound - Amine - Organic oxide - Hydrocarbon derivative - Aliphatic acyclic compound
• Descrição: This compound belongs to the class of organic compounds known as organosulfonic acids. These are compounds containing the sulfonic acid group, which has the general structure RS(=O)2OH (R is not a hydrogen atom).
• External Descriptors: amino sulfonic acid - ethanolamines - TES

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: Solvent:water, Max Conc. mg/mL: 22.93, Max Conc. mM: 100
• Ponto de fusão (°C): 216 °C(dec.)
• Peso molecular: 229.250 g/mol
• XLogP3: -5.800
• Hydrogen Bond Donor Count: 5
• Hydrogen Bond Acceptor Count: 7
• Rotatable Bond Count: 7
• Exact Mass: 229.062 Da
• Monoisotopic Mass: 229.062 Da
• Topological Polar Surface Area: 135.000 Ų
• Heavy Atom Count: 14
• Formal Charge: 0
• Complexity: 233.000
• 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: 1