175202-75-2

Basic information

• Product Name: 4-(2-THIENYL)PYRIMIDINE-2-THIOL
• Synonyms: ART-CHEM-BB B016361;BUTTPARK 19\07-36;4-(THIEN-2-YL)PYRIMIDINE-2-THIOL;4-(THIOPHEN-2-YL)PYRIMIDINE-2-THIOL;4-(2-THIENYL)-2-PYRIMIDINETHIOL;4-(2-THIENYL)-2-PYRIMIDINYLHYDROSULFIDE;4-(2-THIENYL)PYRIMIDINE-2-THIOL;AKOS B016361
• CAS NO: 175202-75-2
• Molecular Formula: C8H6N2S2
• Molecular Weight: 194.28
• Mol File: 175202-75-2.mol
• Article Data: 1

Chemical Properties

• Melting Point: 206 °C
• Boiling Point: 344.4 °C at 760 mmHg
• Flash Point: 162.1 °C
• Appearance: /
• Density: 1.41
• Vapor Pressure: 6.6E-05mmHg at 25°C
• Refractive Index: 1.746
• CAS DataBase Reference: 4-(2-THIENYL)PYRIMIDINE-2-THIOL(CAS DataBase Reference)
• NIST Chemistry Reference: 4-(2-THIENYL)PYRIMIDINE-2-THIOL(175202-75-2)
• EPA Substance Registry System: 4-(2-THIENYL)PYRIMIDINE-2-THIOL(175202-75-2)

Safety Data

• Hazard Codes: Xn
• Statements: 20/21/22-36/37/38-36-22
• Safety Statements: 26-36/37/39
• Hazardous Substances Data: 175202-75-2(Hazardous Substances Data)

Usage

General Description

4-(2-Thienyl)pyrimidine-2-thiol, also known as 2-Mercapto-4-(2-thienyl)pyrimidine, is a chemical compound with the molecular formula C8H6N2S2. It is a heterocyclic organic compound that contains both nitrogen and sulfur in its structure. This chemical is commonly used as a building block in the synthesis of various pharmaceuticals and agrochemicals. Its thienyl and pyrimidine moieties make it a valuable intermediate for the development of new drugs and crop protection agents. Additionally, this compound has been studied for its potential anticancer, antibacterial, and antifungal properties, making it an important target for further research and development in the field of medicinal and agricultural chemistry.

InChI:InChI=1/C8H6N2S2/c11-8-9-4-3-6(10-8)7-2-1-5-12-7/h1-5H,(H,9,10,11)

Upstream product

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Relevant articles and documents

Syntheses, crystal structures and photophysical properties of d10 transition-metal (Ag+, Cu+, Cd2+ and Zn2+) coordination complexes based on a thiophene-containing heterocyclic thioamide

Four d10 transition-metal coordination complexes 1–4 (1: [Ag2(TPT)2(TPTH)2]; 2: [Cu6(TPT)6]·2DMF; 3: [Cd(TPT)2(TPTH)]·CH3CH2OH, 4: [Zn(TPT)2]n) have been constructed from a newly designed heterocyclic thioamide ligand, TPTH (TPTH?=?4-(thiophen-2-yl)-pyrimidine-2-thiol). All complexes have been structurally elucidated by single crystal X-ray diffraction analyses. Except for 4, which shows a one-dimensional (1-D) chain structure, 1–3 are all discrete coordination complexes featuring dinuclear, hexanuclear and mononuclear entities, respectively. Their photophysical properties have been evaluated in the solid state at room temperature by UV–vis diffuse reflectance and luminescence spectra. Among them, 2 exhibits a strong red luminescence (λem?=?699?nm) with a remarkable red-shift of the maximum emission compared to that of the TPTH ligand (λem?=?536?nm). The red emission observed with 2 is ascribed to a LMCT (ligand-to-metal charge transfer) transition which agrees with the DFT calculations.