2,4-Dimethylthiophen - ≥98% , CAS No.638-00-6

CAS: 638-00-6 Cat. No.: D304246 Summenformel: C₆H₈S Molekulargewicht: 112.19 EG-Nummer: 211-312-3

GRADE & PURITY ≥98%

Synonyms

GEO-01226 | AS-50030 | UNII-Q9B2TF3UVC | 2,4-Dimethylthiophene | 2,4-dimethyl-thiophene | 2,4-Dimethyl Thiophene | Q9B2TF3UVC | A8775 | EN300-111893 | EINECS 211-312-3 | MFCD00130082 | W-200473 | EC-000.1622 | Thiophene, 2,4-dimethyl- | SCHEMBL40746 | AKO

Storage

Lagerung bei -20°C,Argon geladen,getrocknet

Shipped In

Eistruhe + Eispads

Specifications

Synonyme

GEO-01226 | AS-50030 | UNII-Q9B2TF3UVC | 2,4-Dimethylthiophene | 2,4-dimethyl-thiophene | 2,4-Dimethyl Thiophene | Q9B2TF3UVC | A8775 | EN300-111893 | EINECS 211-312-3 | MFCD00130082 | W-200473 | EC-000.1622 | Thiophene, 2,4-dimethyl- | SCHEMBL40746 | AKO

Spezifikationen & Reinheit

≥98%

Storage

Lagerung bei -20°C,Argon geladen,getrocknet

Verschickt in

Eistruhe + Eispads

Reinheit

≥98%

Namen und Kennungen

Pubchem Sid

504753525

Pubchem Sid Url

https://pubchem.ncbi.nlm.nih.gov/substance/504753525

Kanonisches Lächeln

CC1=CC(=CS1)C

IUPAC Name

2,4-dimethylthiophene

InChIKey

CPULIKNSOUFMPL-UHFFFAOYSA-N

INCHI

1S/C6H8S/c1-5-3-6(2)7-4-5/h3-4H,1-2H3

Isomere SMILES

CC1=CC(=CS1)C

Molekulargewicht

112.19

Reaxy-Rn

105446

Reaxys-RN_link_address

https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=105446&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Organoheterocyclic compounds
    • Klasse Heteroaromatic compounds

• Kingdom: Organic compounds
• Superclass: Organoheterocyclic compounds
• Klasse: Heteroaromatic compounds
• Subclass: Not available
• Intermediate Tree Nodes: Not available
• Direct Parent: Heteroaromatic compounds
• Alternative Parents: Thiophenes Hydrocarbon derivatives
• Molecular Framework: Aromatic heteromonocyclic compounds
• Substituents: Heteroaromatic compound - Thiophene - Hydrocarbon derivative - Aromatic heteromonocyclic compound
• Beschreibung: This compound belongs to the class of organic compounds known as heteroaromatic compounds. These are compounds containing an aromatic ring where a carbon atom is linked to an hetero atom.
• 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

• Flammpunkt (°C): 104.972°C
• Siedepunkt (°C): 249.96°C
• Molekulargewicht: 112.190 g/mol
• XLogP3: 2.400
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 0
• Exact Mass: 112.035 Da
• Monoisotopic Mass: 112.035 Da
• Topological Polar Surface Area: 28.200 Ų
• Heavy Atom Count: 7
• Formal Charge: 0
• Complexity: 61.200
• 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?

This product is supplied at ≥98% purity (chemical assay). Lot-specific values are stated on the Certificate of Analysis.

How should this product be stored?

Store at ?20 °C, desiccated, under argon. It is supplied under an argon blanket; reseal under inert gas after each use.

How is this product shipped?

This product ships in an insulated container with ice pads. 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 638-00-6, the molecular formula is C6H8S, and the molecular weight is 112.19 g/mol. InChIKey CPULIKNSOUFMPL-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.