1,2-Ethanedisulfonic Acid Dihydrate - ≥95%(T) , CAS No.5982-56-9

CAS: 5982-56-9 Cat. No.: E404394 분자식: C₂H₆O₆S₂•2H₂O 분자량: 226.21

GRADE & PURITY ≥95%(T)

Synonyms

Ethane-1,2-disulfonic acid--water (1/2) | ethane-1,2-disulfonicaciddihydrate | 1,2-Ethanedisulfonic acid dihydrate [MI] | Ethylenedisulfonic acid (dihydrate) | MFCD26793415 | ethane disulfonic acid dihydrate | SCHEMBL162527 | ethane-1,2-disulfonic acid di

Storage

Room temperature,Argon charged

Specifications

동의어

Ethane-1,2-disulfonic acid--water (1/2) | ethane-1,2-disulfonicaciddihydrate | 1,2-Ethanedisulfonic acid dihydrate [MI] | Ethylenedisulfonic acid (dihydrate) | MFCD26793415 | ethane disulfonic acid dihydrate | SCHEMBL162527 | ethane-1,2-disulfonic acid di

사양 및 순도

≥95%(T)

보관 조건

Room temperature,Argon charged

순수함

≥95%(T)

이름과 식별자

정식 스마일

C(CS(=O)(=O)O)S(=O)(=O)O.O.O

IUPAC Name

ethane-1,2-disulfonic acid;dihydrate

InChIKey

DSGUSEBCDAKBCM-UHFFFAOYSA-N

INCHI

1S/C2H6O6S2.2H2O/c3-9(4,5)1-2-10(6,7)8;;/h1-2H2,(H,3,4,5)(H,6,7,8);2*1H2

이성체 SMILES

C(CS(=O)(=O)O)S(=O)(=O)O.O.O

UN 번호

2585

포장 그룹

III

분자량

226.21

Reaxy-Rn

6300691

Reaxys-RN_link_address

https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=6300691&ln=

Taxonomic Classification

Taxonomy Tree

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

• Kingdom: Organic compounds
• Superclass: Organic acids and derivatives
• 분류: 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
• 설명: 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: 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

화학 및 물리적 특성

• 용해성: Very soluble in Dioxane; Soluble in Ether,Ethanol
• 감도: Air Sensitive
• 녹는점(°C): 112 °C
• 분자량: 226.200 g/mol
• Hydrogen Bond Donor Count: 4
• Hydrogen Bond Acceptor Count: 8
• Rotatable Bond Count: 3
• Exact Mass: 225.982 Da
• Monoisotopic Mass: 225.982 Da
• Topological Polar Surface Area: 128.000 Ų
• Heavy Atom Count: 12
• Formal Charge: 0
• Complexity: 239.000
• 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

자주 묻는 질문

How should this product be stored?

Store at room temperature under argon. It is supplied under an argon blanket; reseal under inert gas after each use.

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

The CAS Number is 5982-56-9, the molecular formula is C2H6O6S2·2H2O, and the molecular weight is 226.21 g/mol. InChIKey DSGUSEBCDAKBCM-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.