1,4-Benzenedithiol - ≥98%(GC) , CAS No.624-39-5

CAS: 624-39-5 Cat. No.: B151928 Summenformel: C₆H₆S₂ Molekulargewicht: 142.23 Beilstein Registry Number: 6(4)5840 EG-Nummer: 677-344-9

QUALITÄT & REINHEIT ≥98%(GC)

Synonyms

MFCD00142541 | 1,4-Benzenedithiol | BBL103921 | Dithiohydroquinone | SCHEMBL64710 | GEO-04155 | CALCIUMUNDECYLENATE | C6H6S2 | 4-mercaptothiophenol | B1505 | DTXSID80405615 | AMY22355 | 1,4-Benzenendithiol | AKOS005207204 | MS-20722 | FT-0606769 | benzene

Storage

Store at 2-8°C,Argon charged

Shipped In

Wet ice

Übersicht

Benzene-1,4-dithiol (BDT) is a class of aromatic dithiol that can be used to form a self-assembled monolayer (SAM) on a variety of surfaces.

Spezifikationen

Synonyme

MFCD00142541 | 1,4-Benzenedithiol | BBL103921 | Dithiohydroquinone | SCHEMBL64710 | GEO-04155 | CALCIUMUNDECYLENATE | C6H6S2 | 4-mercaptothiophenol | B1505 | DTXSID80405615 | AMY22355 | 1,4-Benzenendithiol | AKOS005207204 | MS-20722 | FT-0606769 | benzene

Spezifikationen & Reinheit

≥98%(GC)

Anmeldung

BDT can be used as a cross-linker that facilitates the development of acrylate based light sensitive epoxidized soya bean oil for 3D printing applications. Gold based nanoconstrictions can be fabricated by functionalizing the surface with BDT, which reduc

Storage

Store at 2-8°C,Argon charged

Verschickt in

Wet ice

Dieses Produkt erfordert Kühlkettenversand. Grundversand und andere Economy-Optionen sind nicht verfügbar.

Reinheit

≥98%(GC)

Product Line

B151928-100mg

Namen und Kennungen

Pubchem Sid

508807105

Pubchem Sid Url

https://pubchem.ncbi.nlm.nih.gov/substance/508807105

Kanonisches Lächeln

C1=CC(=CC=C1S)S

IUPAC Name

benzene-1,4-dithiol

InChIKey

WYLQRHZSKIDFEP-UHFFFAOYSA-N

INCHI

1S/C6H6S2/c7-5-1-2-6(8)4-3-5/h1-4,7-8H

Isomere SMILES

C1=CC(=CC=C1S)S

Molekulargewicht

142.23

Beilstein

6(4)5840

Reaxy-Rn

1680022

Reaxys-RN_link_address

https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=1680022&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Benzenoids
    • Klasse Thiophenols

• Kingdom: Organic compounds
• Superclass: Benzenoids
• Klasse: Thiophenols
• Subclass: Not available
• Intermediate Tree Nodes: Not available
• Direct Parent: Thiophenols
• Alternative Parents: Benzene and substituted derivatives Thiols Hydrocarbon derivatives
• Molecular Framework: Aromatic homomonocyclic compounds
• Substituents: Thiophenol - Monocyclic benzene moiety - Arylthiol - Hydrocarbon derivative - Organosulfur compound - Aromatic homomonocyclic compound
• Beschreibung: This compound belongs to the class of organic compounds known as thiophenols. These are compounds containing a thiophenol ring, which a phenol derivative obtained by replacing the oxygen atom from the hydroxyl group (attached to the benzene) by a sulfur 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

• Löslichkeit: Soluble in water.
• Empfindlichkeit: Air & Moisture Sensitive
• Schmelzpunkt (°C): 96.0 - 99.0 °C
• Molekulargewicht: 142.200 g/mol
• XLogP3: 2.100
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 0
• Exact Mass: 141.991 Da
• Monoisotopic Mass: 141.991 Da
• Topological Polar Surface Area: 2.000 Ų
• Heavy Atom Count: 8
• Formal Charge: 0
• Complexity: 54.900
• 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