2,5-Dimethylthiophene - ≥98%(GC) , CAS No.638-02-8

CAS: 638-02-8 Cat. No.: D155809 Fórmula: C₆H₈S Peso molecular: 112.19 Beilstein Registry Number: 106450 Número CE: 211-313-9

GRADE & PURITY ≥98%(GC)

Synonyms

NSC60689 | NSC-60689 | AKOS000121512 | FT-0610484 | EN300-21089 | EINECS 211-313-9 | 2,5-Dimethylthiophene, purum, >=98.0% (GC) | FT-0651650 | A834530 | 2,5-dimethyl thiophene | 2,5-Dimethylthiophene, analytical standard | AKOS016017809 | DTXSID2074295 |

Storage

Room temperature,Argon charged

Shipped In

Normal

Specifications

Sinónimos

NSC60689 | NSC-60689 | AKOS000121512 | FT-0610484 | EN300-21089 | EINECS 211-313-9 | 2,5-Dimethylthiophene, purum, >=98.0% (GC) | FT-0651650 | A834530 | 2,5-dimethyl thiophene | 2,5-Dimethylthiophene, analytical standard | AKOS016017809 | DTXSID2074295 |

Especificações e pureza

≥98%(GC)

Condições de armazenamento de armazenamento

Room temperature,Argon charged

Enviado em

Normal

Pureza

≥98%(GC)

Nomes e identificadores

Pubchem Sid

488181688

Pubchem Sid Url

https://pubchem.ncbi.nlm.nih.gov/substance/488181688

Sorrisos canónicos

CC1=CC=C(S1)C

IUPAC Name

2,5-dimethylthiophene

InChIKey

GWQOOADXMVQEFT-UHFFFAOYSA-N

INCHI

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

SMILES isoméricas

CC1=CC=C(S1)C

WGK Alemanha

3

Número UN

1993

Grupo de embalagem

III

Peso molecular

112.19

Beilstein

106450

Reaxy-Rn

106450

Reaxys-RN_link_address

https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=106450&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Organoheterocyclic compounds
    • Classe Thiophenes
      • Subclass 2,5-disubstituted thiophenes

• Kingdom: Organic compounds
• Superclass: Organoheterocyclic compounds
• Classe: Thiophenes
• Subclass: 2,5-disubstituted thiophenes
• Intermediate Tree Nodes: Not available
• Direct Parent: 2,5-disubstituted thiophenes
• Alternative Parents: Heteroaromatic compounds Hydrocarbon derivatives
• Molecular Framework: Aromatic heteromonocyclic compounds
• Substituents: 2,5-disubstituted thiophene - Heteroaromatic compound - Hydrocarbon derivative - Aromatic heteromonocyclic compound
• Descrição: This compound belongs to the class of organic compounds known as 2,5-disubstituted thiophenes. These are organic compounds containing a thiophene that is disubstituted at the C-2, and C5-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

• Solubilidade: Insoluble in water. Soluble in alcohol, ether and benzene.
• Sensibilidade: Air Sensitive
• Índice de refração: 1.5120
• Ponto de inflamação (°F): 75°F
• Ponto de inflamação (°C): 24 °C
• Ponto de ebulição (°C): 134-136℃
• Ponto de fusão (°C): -63℃
• Peso molecular: 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: 53.200
• 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

Perguntas frequentes

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

This product is supplied at ≥98% purity, determined by gas chromatography (GC). Lot-specific values are stated on the Certificate of Analysis.

How should this product be stored?

Store at room temperature under argon. It is supplied under an argon blanket; reseal under inert gas after each use.

How is this product shipped?

This product ships under standard ambient conditions. No temperature-controlled packaging is required.

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

The CAS Number is 638-02-8, the molecular formula is C6H8S, and the molecular weight is 112.19 g/mol. InChIKey GWQOOADXMVQEFT-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.