Ethanesulfonic acid solution - 70 wt. % in H2O , CAS No.594-45-6

CAS: 594-45-6 Cat. No.: E433026 分子式: C₂H₆O₃S 分子量: 110.13 Beilstein Registry Number: 1743071 EC番号: 209-843-0

グレード＆純度 70 wt. % in H2O

Synonyms

ethane sulfonic acid | 2-ethanesulfonic acid | A917850 | DTXSID5060487 | 599310E3U2 | Ethylsulfonic Acid | Ethanesulfonic acid 70% water | methylmethane sulfonic acid | AS-17305 | SCHEMBL1904 | W-105320 | Ethanesulphonic acid | 1-ethanesulfonic acid | Eth

Storage

Room temperature

仕様

同義語

ethane sulfonic acid | 2-ethanesulfonic acid | A917850 | DTXSID5060487 | 599310E3U2 | Ethylsulfonic Acid | Ethanesulfonic acid 70% water | methylmethane sulfonic acid | AS-17305 | SCHEMBL1904 | W-105320 | Ethanesulphonic acid | 1-ethanesulfonic acid | Eth

仕様と純度

70 wt. % in H2O

法的情報

Arkema Inc.

保管条件

Room temperature

名前と識別子

カノニカル・スマイル

CCS(=O)(=O)O

IUPAC Name

ethanesulfonic acid

InChIKey

CCIVGXIOQKPBKL-UHFFFAOYSA-N

INCHI

1S/C2H6O3S/c1-2-6(3,4)5/h2H2,1H3,(H,3,4,5)

異性体SMILES

CCS(=O)(=O)O

WGKドイツ

3

UN番号

1760

分子量

110.13

Beilstein

1743071

Reaxy-Rn

1743071

Reaxys-RN_link_address

https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=1743071&ln=

Taxonomic Classification

Taxonomy Tree

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

• Kingdom: Organic compounds
• Superclass: Organic acids and derivatives
• 分類: Organic sulfonic acids and derivatives
• Subclass: Organosulfonic acids and derivatives
• Intermediate Tree Nodes: Not available
• Direct Parent: Organosulfonic acids
• Alternative Parents: Sulfonyls Alkanesulfonic acids Organic oxides Hydrocarbon derivatives
• Molecular Framework: Aliphatic acyclic compounds
• Substituents: Alkanesulfonic acid - Sulfonyl - Organosulfonic acid - Organic oxygen compound - Organic oxide - Hydrocarbon derivative - Organosulfur compound - Aliphatic acyclic compound
• 説明: 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: alkanesulfonic acid

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

化学的性質と物理的性質

• 屈折率: 1.434
• 引火点（°F）: 235.4 °F
• 引火点（°C）: 113 °C
• 沸点（°C）: 123°C
• 融点（°C）: -17°C
• 分子量: 110.130 g/mol
• XLogP3: -0.500
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 1
• Exact Mass: 110.004 Da
• Monoisotopic Mass: 110.004 Da
• Topological Polar Surface Area: 62.800 Ų
• Heavy Atom Count: 6
• Formal Charge: 0
• Complexity: 105.000
• 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

よくある質問

How should this product be stored?

Store at room temperature.

What are the CAS number, molecular formula and molecular weight?

The CAS Number is 594-45-6, the molecular formula is C2H6O3S, and the molecular weight is 110.13 g/mol. InChIKey CCIVGXIOQKPBKL-UHFFFAOYSA-N.

What documentation is provided?

Available product documentation, including Certificates of Analysis (COA), Safety Data Sheets (SDS), and specification sheets, is shown in the product document area. Document availability and access follow the current site policy.