1,4-Benzenedimethanethiol - ≥98%, used for 1,4-Benzenedimethanethiol was used as cross linker in the fabrication of nanoporous gold on glassy carbon electrode by alternatively assembling gold nanoparticles and silver nanoparticles. It was used as capping

CAS: 105-09-9 Cat. No.: B101791 Summenformel: C₆H₄(CH₂SH)₂ Molekulargewicht: 170.30 Beilstein Registry Number: 6919 EG-Nummer: 203-269-4

GRADE & PURITY ≥98%

Synonyms

1,4-Benzenedimethanethiol, 98% | alpha,alpha'-p-Xylenedithiol | 1,4-Benzenebis(methanethiol) | MFCD00004872 | AC-16428 | 1,4-Benzene dimethanethiol | 10.14272/IYPNRTQAOXLCQW-UHFFFAOYSA-N.1 | EINECS 203-269-4 | NCIOpen2_000587 | T70041 | 1,4-Benzenedimetha

Storage

Room temperature,Argon charged,Desiccated

Shipped In

Normal

Übersicht

1,4-Benzenedimethanethiol forms self-assembled monolayers on gold in n-hexane solution.

Specifications

Synonyme

1,4-Benzenedimethanethiol, 98% | alpha,alpha'-p-Xylenedithiol | 1,4-Benzenebis(methanethiol) | MFCD00004872 | AC-16428 | 1,4-Benzene dimethanethiol | 10.14272/IYPNRTQAOXLCQW-UHFFFAOYSA-N.1 | EINECS 203-269-4 | NCIOpen2_000587 | T70041 | 1,4-Benzenedimetha

Spezifikationen & Reinheit

≥98%

Anmeldung

1,4-Benzenedimethanethiol was used as cross linker in the fabrication of nanoporous gold on glassy carbon electrode by alternatively assembling gold nanoparticles and silver nanoparticles. It was used as capping reagent during the preparation of Au and Ag

Storage

Room temperature,Argon charged,Desiccated

Verschickt in

Normal

Reinheit

≥98%

Namen und Kennungen

Pubchem Sid

488183712

Pubchem Sid Url

https://pubchem.ncbi.nlm.nih.gov/substance/488183712

Kanonisches Lächeln

C1=CC(=CC=C1CS)CS

IUPAC Name

[4-(sulfanylmethyl)phenyl]methanethiol

InChIKey

IYPNRTQAOXLCQW-UHFFFAOYSA-N

INCHI

1S/C8H10S2/c9-5-7-1-2-8(6-10)4-3-7/h1-4,9-10H,5-6H2

Isomere SMILES

C1=CC(=CC=C1CS)CS

WGK Deutschland

3

Molekulargewicht

170.30

Beilstein

6919

Reaxy-Rn

1364036

Reaxys-RN_link_address

https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=1364036&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Benzenoids
    • Klasse Benzene and substituted derivatives

• Kingdom: Organic compounds
• Superclass: Benzenoids
• Klasse: Benzene and substituted derivatives
• Subclass: Not available
• Intermediate Tree Nodes: Not available
• Direct Parent: Benzene and substituted derivatives
• Alternative Parents: Alkylthiols Hydrocarbon derivatives
• Molecular Framework: Aromatic homomonocyclic compounds
• Substituents: Monocyclic benzene moiety - Alkylthiol - Hydrocarbon derivative - Organosulfur compound - Aromatic homomonocyclic compound
• Beschreibung: This compound belongs to the class of organic compounds known as benzene and substituted derivatives. These are aromatic compounds containing one monocyclic ring system consisting of benzene.
• 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

• Empfindlichkeit: Air sensitive
• Flammpunkt (°F): 235.4 °F
• Flammpunkt (°C): 113 °C
• Siedepunkt (°C): 156°C/12mmHg
• Schmelzpunkt (°C): 45-46°C
• Molekulargewicht: 170.300 g/mol
• XLogP3: 2.100
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 2
• Exact Mass: 170.022 Da
• Monoisotopic Mass: 170.022 Da
• Topological Polar Surface Area: 2.000 Ų
• Heavy Atom Count: 10
• Formal Charge: 0
• Complexity: 73.300
• 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

Häufig gestellte Fragen

What is the purity of this product?

This product is supplied at ≥98% purity (chemical assay). Lot-specific values are stated on the Certificate of Analysis.

How should this product be stored?

Store in a cool place, desiccated, 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 105-09-9, the molecular formula is C8H10S2, and the molecular weight is 170.30 g/mol. InChIKey IYPNRTQAOXLCQW-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.