Bis(dodecylsulfanylthiocarbonyl) disulfide - ≥95% , CAS No.870532-86-8

CAS: 870532-86-8 Cat. No.: B463501 Molecular Weight: 555.07

GRADE & PURITY ≥95%

Synonyms

bis-(dodecylsulfanylthiocarbonyl)disulfide | SCHEMBL2771539 | dodecylsulfanyl-(dodecylsulfanylcarbothioyldisulfanyl)methanethione | Bis(dodecylsulfanylthiocarbonyl) disulfide, 98% (HPLC) | UUNRYKCXJSDLRD-UHFFFAOYSA-N | Bis(dodecylsulfanylthiocarbonyl) dis

Storage

Store at -20°C

Shipped In

Ice chest + Ice pads

Overview

Description

Need help choosing the correct RAFT Agent? Please consult the RAFT Agent to Monomercompatibility table.Reversible Addition Fragmentation Chain Transfer (RAFT) PolymerizationPrecursor for the synthesis of RAFT agents for controlled radical polymerization.

Specifications

Synonyms

bis-(dodecylsulfanylthiocarbonyl)disulfide | SCHEMBL2771539 | dodecylsulfanyl-(dodecylsulfanylcarbothioyldisulfanyl)methanethione | Bis(dodecylsulfanylthiocarbonyl) disulfide, 98% (HPLC) | UUNRYKCXJSDLRD-UHFFFAOYSA-N | Bis(dodecylsulfanylthiocarbonyl) dis

Specifications & Purity

≥95%

Storage

Store at -20°C

Shipped In

Ice chest + Ice pads

This product requires cold chain shipping. Ground and other economy services are not available.

Purity

≥95%

Names and Identifiers

• Canonical Smiles: CCCCCCCCCCCCSC(=S)SSC(=S)SCCCCCCCCCCCC
• IUPAC Name: dodecylsulfanyl-(dodecylsulfanylcarbothioyldisulfanyl)methanethione
• InChIKey: UUNRYKCXJSDLRD-UHFFFAOYSA-N
• INCHI: 1S/C26H50S6/c1-3-5-7-9-11-13-15-17-19-21-23-29-25(27)31-32-26(28)30-24-22-20-18-16-14-12-10-8-6-4-2/h3-24H2,1-2H3
• Isomeric SMILES: CCCCCCCCCCCCSC(=S)SSC(=S)SCCCCCCCCCCCC
• Molecular Weight: 555.07
• Reaxy-Rn: 6740299
• Reaxys-RN_link_address: https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=6740299&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Organosulfur compounds
    • Class Organic disulfides

• Kingdom: Organic compounds
• Superclass: Organosulfur compounds
• Class: Organic disulfides
• Subclass: Not available
• Intermediate Tree Nodes: Not available
• Direct Parent: Organic disulfides
• Alternative Parents: Sulfenyl compounds Hydrocarbon derivatives
• Molecular Framework: Aliphatic acyclic compounds
• Substituents: Organic disulfide - Sulfenyl compound - Hydrocarbon derivative - Aliphatic acyclic compound
• Description: This compound belongs to the class of organic compounds known as organic disulfides. These are organosulfur compounds with the general formula RSSR' (R,R' = alkyl, aryl).
• 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

Chemical and Physical Properties

• Flash Point(°F): Not applicable
• Flash Point(°C): Not applicable
• Melt Point(°C): 30-35℃
• Molecular Weight: 555.100 g/mol
• XLogP3: 14.700
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 6
• Rotatable Bond Count: 27
• Exact Mass: 554.224 Da
• Monoisotopic Mass: 554.224 Da
• Topological Polar Surface Area: 165.000 Ų
• Heavy Atom Count: 32
• Formal Charge: 0
• Complexity: 375.000
• 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