Ethylene trithiocarbonate - ≥97% , CAS No.822-38-8

CAS: 822-38-8 Cat. No.: E124195 Fórmula: C₃H₄S₃ Peso molecular: 136.26 Beilstein Registry Number: 106330 Número CE: 212-498-9

GRAU & PUREZA ≥97%

Synonyms

1,3-Dithiolan-2-thione | EINECS 212-498-9 | E0323 | Ethylene trithiocarbonate | Ethylene trithiocarbonate, 97% | XCWPBWWTGHQKDR-UHFFFAOYSA- | NSC6746 | NSC-6746 | 1,3-Dithiolane-2-thione | Trithiocarbonic acid, cyclic ethylene ester | CARBONIC ACID, TRITH

Storage

Store at 2-8°C,Protected from light

Shipped In

Wet ice

Especificações

Sinónimos

1,3-Dithiolan-2-thione | EINECS 212-498-9 | E0323 | Ethylene trithiocarbonate | Ethylene trithiocarbonate, 97% | XCWPBWWTGHQKDR-UHFFFAOYSA- | NSC6746 | NSC-6746 | 1,3-Dithiolane-2-thione | Trithiocarbonic acid, cyclic ethylene ester | CARBONIC ACID, TRITH

Especificações e pureza

≥97%

Condições de armazenamento de armazenamento

Store at 2-8°C,Protected from light

Enviado em

Wet ice

Este produto requer transporte de cadeia fria. Serviços terrestres e outros serviços econômicos não estão disponíveis.

Pureza

≥97%

Nomes e identificadores

Pubchem Sid

488181810

Pubchem Sid Url

https://pubchem.ncbi.nlm.nih.gov/substance/488181810

Sorrisos canónicos

C1CSC(=S)S1

IUPAC Name

1,3-dithiolane-2-thione

InChIKey

XCWPBWWTGHQKDR-UHFFFAOYSA-N

INCHI

1S/C3H4S3/c4-3-5-1-2-6-3/h1-2H2

SMILES isoméricas

C1CSC(=S)S1

WGK Alemanha

3

RTECS

FG2720000

Peso molecular

136.26

Beilstein

106330

Reaxy-Rn

106330

Reaxys-RN_link_address

https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=106330&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Organoheterocyclic compounds
    • Classe Dithiolanes
      • Subclass 1,3-dithiolanes

• Kingdom: Organic compounds
• Superclass: Organoheterocyclic compounds
• Classe: Dithiolanes
• Subclass: 1,3-dithiolanes
• Intermediate Tree Nodes: Not available
• Direct Parent: 1,3-dithiolanes
• Alternative Parents: Organosulfur compounds Hydrocarbon derivatives
• Molecular Framework: Aliphatic heteromonocyclic compounds
• Substituents: 1,3-dithiolane - Hydrocarbon derivative - Organosulfur compound - Aliphatic heteromonocyclic compound
• Descrição: This compound belongs to the class of organic compounds known as 1,3-dithiolanes. These are organic compounds containing a 1,3-dithiolane ring. 1,3-dithiolane moiety is a 5-membered saturated aliphatic ring with three carbon atoms, and two sulfur atoms at the 1- and 3- ring positions.
• 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

Propriedades químicas e físicas

• Sensibilidade: Light sensitive
• Ponto de inflamação (°F): 325.4 °F
• Ponto de inflamação (°C): 163 °C
• Ponto de ebulição (°C): 307°C
• Ponto de fusão (°C): 35°C
• Peso molecular: 136.300 g/mol
• XLogP3: 2.000
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 0
• Exact Mass: 135.948 Da
• Monoisotopic Mass: 135.948 Da
• Topological Polar Surface Area: 82.700 Ų
• Heavy Atom Count: 6
• Formal Charge: 0
• Complexity: 60.400
• 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

Perguntas frequentes

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.

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 822-38-8, the molecular formula is C3H4S3, and the molecular weight is 136.26 g/mol. InChIKey XCWPBWWTGHQKDR-UHFFFAOYSA-N.

What is the purity of this product?

This product is supplied at ≥97% purity (chemical assay). 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.