3,4-Dimethoxythiophene - ≥97% , CAS No.51792-34-8

CAS: 51792-34-8 Cat. No.: D103168 Formula: C₆H₈O₂S Molecular Weight: 144.19 EC Number: 628-711-7

GRADE & PURITY ≥97%

Synonyms

A15612 | AC-4907 | SCHEMBL273191 | Q-101198 | 3,4-Dimethoxythiophene, 97% | FT-0640027 | 3,4-Dimethoxythiophene | 3,4-dimethoxy-thiophene | Thiophene, 3,4-dimethoxy- | BCP27307 | AS-14512 | BP-20237 | AM20100270 | D2728 | MFCD01096546 | DTXSID90394208 | S

Storage

Protected from light,Store at -20°C,Argon charged

Shipped In

Ice chest + Ice pads

Overview

3,4-Dimethoxythiophene (DMOT) is a monomer and a precursor which can be synthesized by ring closure reaction of 2,3-dimethoxy-1,3-butadiene and sulfur dichloride in hexane medium. It is an oligothiphene that is majorly used in the development of electroactive materials for organic electronics based applications.

Specifications

Synonyms

A15612 | AC-4907 | SCHEMBL273191 | Q-101198 | 3,4-Dimethoxythiophene, 97% | FT-0640027 | 3,4-Dimethoxythiophene | 3,4-dimethoxy-thiophene | Thiophene, 3,4-dimethoxy- | BCP27307 | AS-14512 | BP-20237 | AM20100270 | D2728 | MFCD01096546 | DTXSID90394208 | S

Specifications & Purity

≥97%

Storage

Protected from light,Store at -20°C,Argon charged

Shipped In

Ice chest + Ice pads

This product requires cold chain shipping. Ground and other economy services are not available.

Purity

≥97%

Names and Identifiers

Pubchem Sid

504762632

Pubchem Sid Url

https://pubchem.ncbi.nlm.nih.gov/substance/504762632

Canonical Smiles

COC1=CSC=C1OC

IUPAC Name

3,4-dimethoxythiophene

InChIKey

ZUDCKLVMBAXBIF-UHFFFAOYSA-N

INCHI

1S/C6H8O2S/c1-7-5-3-9-4-6(5)8-2/h3-4H,1-2H3

Isomeric SMILES

COC1=CSC=C1OC

WGK Germany

3

Molecular Weight

144.19

Reaxy-Rn

111087

Reaxys-RN_link_address

https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=111087&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Organic oxygen compounds
    • Class Organooxygen compounds
      • Subclass Ethers

• Kingdom: Organic compounds
• Superclass: Organic oxygen compounds
• Class: Organooxygen compounds
• Subclass: Ethers
• Intermediate Tree Nodes: Not available
• Direct Parent: Alkyl aryl ethers
• Alternative Parents: Thiophenes Heteroaromatic compounds Hydrocarbon derivatives
• Molecular Framework: Aromatic heteromonocyclic compounds
• Substituents: Alkyl aryl ether - Heteroaromatic compound - Thiophene - Organoheterocyclic compound - Hydrocarbon derivative - Aromatic heteromonocyclic compound
• Description: This compound belongs to the class of organic compounds known as alkyl aryl ethers. These are organic compounds containing the alkyl aryl ether functional group with the generic formula R-O-R' , where R is an alkyl group and R' is an aryl group.
• 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

Chemical and Physical Properties

• Solubility: Miscible with organic solvents. Slightly miscible with water.
• Sensitivity: Light & Air Sensitive
• Refractive Index: 1.5409
• Flash Point(°F): 222.8℉
• Flash Point(°C): 106°C
• Boil Point(°C): 100-102°C
• Molecular Weight: 144.190 g/mol
• XLogP3: 1.500
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 2
• Exact Mass: 144.025 Da
• Monoisotopic Mass: 144.025 Da
• Topological Polar Surface Area: 46.700 Ų
• Heavy Atom Count: 9
• Formal Charge: 0
• Complexity: 77.100
• 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