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

CAS: 822-38-8 Cat. No.: E124195 Formule: C₃H₄S₃ Poids moléculaire: 136.26 Beilstein Registry Number: 106330 Numéro CE: 212-498-9

QUALITÉ & PURETÉ ≥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

Spécifications

Synonymes

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

Spécifications et pureté

≥97%

Conditions de stockage de stockage

Store at 2-8°C,Protected from light

Expédié en

Wet ice

Ce produit nécessite l'expédition en chaîne froide. Les services terrestres et autres services économiques ne sont pas disponibles.

Pureté

≥97%

Noms et identifiants

Pubchem Sid

488181810

Pubchem Sid Url

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

Sourires canoniques

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

Isomères SMILES

C1CSC(=S)S1

WGK Allemagne

3

RTECS

FG2720000

Poids moléculaire

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
• Description: 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

Propriétés chimiques et physiques

• Sensibilité: Light sensitive
• Point d'éclair (°F): 325.4 °F
• Point d'éclair (°C): 163 °C
• Point d'ébullition (°C): 307°C
• Point de fusion (°C): 35°C
• Poids moléculaire: 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

Foire aux questions

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.