ADT - sublimed grade, ≥97% , CAS No.144413-58-1

CAS: 144413-58-1 Cat. No.: A432101 Fórmula: C18H10S2 Número CE: 694-460-5

GRADE & PURITY Sublimed grade, ≥97%

Synonyms

6,16-dithiapentacyclo[11.7.0.0^{3,11.0^{5,9.0^{15,19]icosa-1,3(11),4,7,9,12,14,17,19-nonaene | ADT, sublimed, 97% | Anthra[2,3-b:6,7-b']bisthiophene | Anthra[2,3-b:6,7-b inverted exclamation mark ]dithiophene | MFCD20257134 | DTXSID60571206 | ADT, Aldrich

Storage

Room temperature

Visão geral

General Description

ADT is an anthradithiophene based small molecule semiconductor that contributes to a new class of heteroacenes, which has a 22-electron π-conjugated system. It can be majorly used in a variety of organic electronic applications.

Application

ADT can be used as a conducting polymer in the fabrication of organic field effect transistors (OFETs) and organic photovoltaics (OPVs).

Specifications

Sinónimos

6,16-dithiapentacyclo[11.7.0.0^{3,11.0^{5,9.0^{15,19]icosa-1,3(11),4,7,9,12,14,17,19-nonaene | ADT, sublimed, 97% | Anthra[2,3-b:6,7-b']bisthiophene | Anthra[2,3-b:6,7-b inverted exclamation mark ]dithiophene | MFCD20257134 | DTXSID60571206 | ADT, Aldrich

Especificações e pureza

sublimed grade, ≥97%

Condições de armazenamento de armazenamento

Room temperature

Grau

Sublimed grade

Pureza

≥97%

Nomes e identificadores

• Sorrisos canónicos: C1=CSC2=CC3=CC4=C(C=C3C=C21)C=C5C(=C4)C=CS5
• IUPAC Name: 6,16-dithiapentacyclo[11.7.0.03,11.05,9.015,19]icosa-1,3(11),4,7,9,12,14,17,19-nonaene
• InChIKey: DAMUWSYTQPWFIY-UHFFFAOYSA-N
• INCHI: 1S/C18H10S2/c1-3-19-17-9-15-8-14-6-12-2-4-20-18(12)10-16(14)7-13(15)5-11(1)17/h1-10H
• SMILES isoméricas: C1=CSC2=CC3=CC4=C(C=C3C=C21)C=C5C(=C4)C=CS5
• Reaxy-Rn: 7876921
• Reaxys-RN_link_address: https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=7876921&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Benzenoids
    • Classe Anthracenes

• Kingdom: Organic compounds
• Superclass: Benzenoids
• Classe: Anthracenes
• Subclass: Not available
• Intermediate Tree Nodes: Not available
• Direct Parent: Anthracenes
• Alternative Parents: Naphthothiophenes 1-benzothiophenes Thiophenes Heteroaromatic compounds Hydrocarbon derivatives
• Molecular Framework: Aromatic heteropolycyclic compounds
• Substituents: Anthracene - Naphthothiophene - 1-benzothiophene - Benzothiophene - Heteroaromatic compound - Thiophene - Organoheterocyclic compound - Hydrocarbon derivative - Aromatic heteropolycyclic compound
• Descrição: This compound belongs to the class of organic compounds known as anthracenes. These are organic compounds containing a system of three linearly fused benzene rings.
• 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

• Peso molecular: 290.400 g/mol
• XLogP3: 6.100
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 0
• Exact Mass: 290.022 Da
• Monoisotopic Mass: 290.022 Da
• Topological Polar Surface Area: 56.500 Ų
• Heavy Atom Count: 20
• Formal Charge: 0
• Complexity: 346.000
• 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

Perguntas frequentes

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.

What does sublimed grade mean?

sublimed grade indicates that the material has been processed and tested for specialty industrial processing. Specifications focus on the impurities that affect performance in that application — for example, metal content for electronics, particle size for batteries, refractive index for optics, or moisture content for moisture-sensitive processes.

How should this product be stored?

Store at room temperature.

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

The CAS Number is 144413-58-1, the molecular formula is C18H10S2. InChIKey DAMUWSYTQPWFIY-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.