1,2-Ethanediyl Bismethanethiosulfonate - ≥95% , CAS No.55-95-8

CAS: 55-95-8 Cat. No.: E340318 Summenformel: C₄H₁₀O₄S₄ Molekulargewicht: 250.38 EG-Nummer: 874-732-1

GRADE & PURITY ≥95%

Synonyms

FT-0668049 | GTLRPXXCQSUDLL-UHFFFAOYSA-N | S-(2-([Methyl(dioxido)sulfanyl]sulfanyl)ethyl) methanesulfonothioate # | 1,2-Ethanedithiol Dimethanesulfonate | S,S'-Ethylene bis(methanethiosulfonate) | Preparation 289 | 1,2-bis(methylsulfonylsulfanyl)ethane |

Storage

Store at -20°C

Shipped In

Ice chest + Ice pads

Übersicht

1,2-Ethanediyl Bismethanethiosulfonate is a homobifunctional sulfhydryl-reactive crosslinker with a 4 atom spacer arm.

Specifications

Synonyme

FT-0668049 | GTLRPXXCQSUDLL-UHFFFAOYSA-N | S-(2-([Methyl(dioxido)sulfanyl]sulfanyl)ethyl) methanesulfonothioate # | 1,2-Ethanedithiol Dimethanesulfonate | S,S'-Ethylene bis(methanethiosulfonate) | Preparation 289 | 1,2-bis(methylsulfonylsulfanyl)ethane |

Spezifikationen & Reinheit

≥95%

Storage

Store at -20°C

Verschickt in

Ice chest + Ice pads

Dieses Produkt erfordert Kühlkettenversand. Grundversand und andere Economy-Optionen sind nicht verfügbar.

Reinheit

≥95%

Namen und Kennungen

Pubchem Sid

504759272

Pubchem Sid Url

https://pubchem.ncbi.nlm.nih.gov/substance/504759272

Kanonisches Lächeln

CS(=O)(=O)SCCSS(=O)(=O)C

IUPAC Name

1,2-bis(methylsulfonylsulfanyl)ethane

InChIKey

GTLRPXXCQSUDLL-UHFFFAOYSA-N

INCHI

1S/C4H10O4S4/c1-11(5,6)9-3-4-10-12(2,7)8/h3-4H2,1-2H3

Isomere SMILES

CS(=O)(=O)SCCSS(=O)(=O)C

Molekulargewicht

250.38

Reaxy-Rn

1911495

Reaxys-RN_link_address

https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=1911495&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Organosulfur compounds
    • Klasse Sulfonyls

• Kingdom: Organic compounds
• Superclass: Organosulfur compounds
• Klasse: Sulfonyls
• Subclass: Not available
• Intermediate Tree Nodes: Not available
• Direct Parent: Sulfonyls
• Alternative Parents: Sulfenyl compounds Organic oxides Hydrocarbon derivatives
• Molecular Framework: Aliphatic acyclic compounds
• Substituents: Sulfonyl - Sulfenyl compound - Organic oxygen compound - Organic oxide - Hydrocarbon derivative - Aliphatic acyclic compound
• Beschreibung: This compound belongs to the class of organic compounds known as sulfonyls. These are compounds containing the sulfonyl group, with the general structure RS(=O)2R' ( R,R' must not be H).
• 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

Chemische und physikalische Eigenschaften

• Löslichkeit: Soluble in dichloromethane, DMF, DMSO, and water.
• Brechungsindex: n20D1.57 (Predicted)
• Siedepunkt (°C): 520.90° C at 760 mmHg (Predicted)
• Schmelzpunkt (°C): 116-118° C (lit.)
• Molekulargewicht: 250.400 g/mol
• XLogP3: -0.100
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 6
• Rotatable Bond Count: 5
• Exact Mass: 249.946 Da
• Monoisotopic Mass: 249.946 Da
• Topological Polar Surface Area: 136.000 Ų
• Heavy Atom Count: 12
• Formal Charge: 0
• Complexity: 268.000
• 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