2-(Dodecylthiocarbonothioylthio)-2-methylpropionic acid（DDMAT） - ≥97%(HPLC) , CAS No.461642-78-4

CAS: 461642-78-4 Cat. No.: D138874 Summenformel: C₁₇H₃₂O₂S₃ Molekulargewicht: 364.63 EG-Nummer: 663-505-0

GRADE & PURITY ≥97%(HPLC)

Synonyms

2-(((Dodecylthio)carbonothioyl)thio)-2-methylpropanoic acid | 2-(Dodecylthiocarbonothioylthio)-2-methylpropionic acid | 2-Methyl-2-[(dodecylsulfanylthiocarbonyl)sulfanyl]propanoic acid | 2-dodecylsulfanylcarbothioylsulfanyl-2-methylpropanoic acid | DDMAT

Storage

Store at 2-8°C,Protected from light

Shipped In

Wet ice

Übersicht

RAFT agent,usually used for the polymerization of styrene, acrylate and acrylamide monomers.

Specifications

Synonyme

2-(((Dodecylthio)carbonothioyl)thio)-2-methylpropanoic acid | 2-(Dodecylthiocarbonothioylthio)-2-methylpropionic acid | 2-Methyl-2-[(dodecylsulfanylthiocarbonyl)sulfanyl]propanoic acid | 2-dodecylsulfanylcarbothioylsulfanyl-2-methylpropanoic acid | DDMAT

Spezifikationen & Reinheit

≥97%(HPLC)

Storage

Store at 2-8°C,Protected from light

Verschickt in

Wet ice

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

Reinheit

≥97%(HPLC)

Namen und Kennungen

Pubchem Sid

488197533

Pubchem Sid Url

https://pubchem.ncbi.nlm.nih.gov/substance/488197533

Kanonisches Lächeln

CCCCCCCCCCCCSC(=S)SC(C)(C)C(=O)O

IUPAC Name

2-dodecylsulfanylcarbothioylsulfanyl-2-methylpropanoic acid

InChIKey

DZFGVGDQHQHOKZ-UHFFFAOYSA-N

INCHI

1S/C17H32O2S3/c1-4-5-6-7-8-9-10-11-12-13-14-21-16(20)22-17(2,3)15(18)19/h4-14H2,1-3H3,(H,18,19)

Isomere SMILES

CCCCCCCCCCCCSC(=S)SC(C)(C)C(=O)O

WGK Deutschland

3

Molekulargewicht

364.63

Reaxy-Rn

9938905

Reaxys-RN_link_address

https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=9938905&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Lipids and lipid-like molecules
    • Klasse Fatty Acyls
      • Subclass Fatty acids and conjugates

• Kingdom: Organic compounds
• Superclass: Lipids and lipid-like molecules
• Klasse: Fatty Acyls
• Subclass: Fatty acids and conjugates
• Intermediate Tree Nodes: Not available
• Direct Parent: Branched fatty acids
• Alternative Parents: Sulfenyl compounds Monocarboxylic acids and derivatives Carboxylic acids Organic oxides Hydrocarbon derivatives Carbonyl compounds
• Molecular Framework: Aliphatic acyclic compounds
• Substituents: Branched fatty acid - Sulfenyl compound - Monocarboxylic acid or derivatives - Carboxylic acid - Carboxylic acid derivative - Organic oxygen compound - Organic oxide - Hydrocarbon derivative - Organosulfur compound - Organooxygen compound - Carbonyl group - Aliphatic acyclic compound
• Beschreibung: This compound belongs to the class of organic compounds known as branched fatty acids. These are fatty acids containing a branched chain.
• 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

• Empfindlichkeit: Light & Heat sensitive
• Schmelzpunkt (°C): 57-63°C
• Molekulargewicht: 364.600 g/mol
• XLogP3: 8.000
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 5
• Rotatable Bond Count: 15
• Exact Mass: 364.156 Da
• Monoisotopic Mass: 364.156 Da
• Topological Polar Surface Area: 120.000 Ų
• Heavy Atom Count: 22
• Formal Charge: 0
• Complexity: 317.000
• 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

Häufig gestellte Fragen

What is the purity of this product, and how is it determined?

This product is supplied at ≥97% purity, determined by HPLC. Lot-specific values are stated on the Certificate of Analysis.

How should this product be stored?

Store at 2–8 °C, protected from light. The material is light-sensitive — keep it in its original opaque or amber container.

How is this product shipped?

This product ships chilled on wet ice. Unpack on arrival and transfer it to the storage condition stated above.

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

The CAS Number is 461642-78-4, the molecular formula is C17H32O2S3, and the molecular weight is 364.63 g/mol. InChIKey DZFGVGDQHQHOKZ-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.