Dithieno[3,2-b:2',3'-d]thiophene - ≥98% , CAS No.3593-75-7

CAS: 3593-75-7 Cat. No.: D119993 Molecular Weight: 196.31 EC Number: 687-362-9

GRADE & PURITY ≥98%

Synonyms

C8H4S3 | MFCD06656577 | Dithieno(3,2-b:2',3'-d)thiophene | 3,7,11-trithiatricyclo[6.3.0.0^{2,6]undeca-1(8),2(6),4,9-tetraene | SCHEMBL637062 | dithieno[3,2-b;2',3'-d]thiophene | Dithieno[3,2-b:2',3'-d]thiophene | Dithieno[3,2-b:2,3-d]thiophene | FT-067752

Storage

Argon charged,Room temperature

Shipped In

Normal

Overview

Product Introduction

Dithieno[3,2-b:2′,3′-d]thiophene (DTT) is a conductive material that acts as a donor building block for synthesizing a variety of optoelectronic materials. It can be used as an active layer with high charge mobility and environmental stability for development of organic electronic devices.

Application

DTT can be used for a wide range of applications which include electro-luminescence, organic thin film transistors, photochromism, and organic photovoltaic (OPV) solar cells.

Specifications

Synonyms

C8H4S3 | MFCD06656577 | Dithieno(3, 2-b:2', 3'-d)thiophene | 3, 7, 11-trithiatricyclo[6.3.0.0^{2, 6]undeca-1(8), 2(6), 4, 9-tetraene | SCHEMBL637062 | dithieno[3, 2-b;2', 3'-d]thiophene | Dithieno[3, 2-b:2', 3'-d]thiophene | Dithieno[3, 2-b:2, 3-d]thiophene | FT-067752

Specifications & Purity

≥98%

Storage

Argon charged, Room temperature

Shipped In

Normal

Purity

≥98%

Names and Identifiers

• Pubchem Sid: 488187976
• Pubchem Sid Url: https://pubchem.ncbi.nlm.nih.gov/substance/488187976
• Canonical Smiles: C1=CSC2=C1SC3=C2SC=C3
• IUPAC Name: 3,7,11-trithiatricyclo[6.3.0.02,6]undeca-1(8),2(6),4,9-tetraene
• InChIKey: VGWBXRXNERKBSJ-UHFFFAOYSA-N
• INCHI: 1S/C8H4S3/c1-3-9-7-5(1)11-6-2-4-10-8(6)7/h1-4H
• Isomeric SMILES: C1=CSC2=C1SC3=C2SC=C3
• WGK Germany: 2
• Molecular Weight: 196.31
• Reaxy-Rn: 1424967
• Reaxys-RN_link_address: https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=1424967&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Organoheterocyclic compounds
    • Class Thienothiophenes

• Kingdom: Organic compounds
• Superclass: Organoheterocyclic compounds
• Class: Thienothiophenes
• Subclass: Not available
• Intermediate Tree Nodes: Not available
• Direct Parent: Thienothiophenes
• Alternative Parents: Thiophenes Heteroaromatic compounds Hydrocarbon derivatives
• Molecular Framework: Aromatic heteropolycyclic compounds
• Substituents: Thienothiophene - Heteroaromatic compound - Thiophene - Hydrocarbon derivative - Aromatic heteropolycyclic compound
• Description: This compound belongs to the class of organic compounds known as thienothiophenes. These are organic compounds containing two thiophene rings fused to each other.
• 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: Soluble in Toluene
• Sensitivity: Air Sensitive
• Boil Point(°C): 138°C
• Melt Point(°C): 67°C
• Molecular Weight: 196.300 g/mol
• XLogP3: 3.800
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 0
• Exact Mass: 195.948 Da
• Monoisotopic Mass: 195.948 Da
• Topological Polar Surface Area: 84.700 Ų
• Heavy Atom Count: 11
• Formal Charge: 0
• Complexity: 153.000
• 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