Description

2,2′-Bipyridine; ((trifluoromethyl)sulfanyl)copper (CAS: 1413732-47-4) is a highly specialized organometallic compound with the molecular formula C₁₁H₈CuF₃N₂S. This product is meticulously synthesized for advanced research applications, offering exceptional purity and stability. The compound features a copper center coordinated with a 2,2′-bipyridine ligand and a trifluoromethylsulfanyl group, making it a valuable reagent in catalysis, materials science, and synthetic chemistry. Its unique structural properties enable precise control in cross-coupling reactions, photophysical studies, and ligand design. Packaged under inert conditions to ensure longevity, this product is ideal for researchers requiring reliable and high-performance reagents.

Properties

• CAS Number: 1413732-47-4
• Complexity: 201
• IUPAC Name: cuprous;2-(2-pyridyl)pyridine;trifluoromethanethiolate
• InChI: InChI=1S/C10H8N2.CHF3S.Cu/c1-3-7-11-9(5-1)10-6-2-4-8-12-10;2-1(3,4)5;/h1-8H;5H;/q;;+1/p-1
• InChI Key: TWUWEXFRMUWRRW-UHFFFAOYSA-M
• Exact Mass: 319.965626
• Molecular Formula: C11H8CuF3N2S
• Molecular Weight: 320.80
• SMILES: C1=CC=NC(=C1)C2=CC=CC=N2.C(F)(F)(F)[S-].[Cu+]
• Topological: 26.8
• Monoisotopic Mass: 319.965626
• Synonyms: 2,2′-Bipyridine; ((trifluoromethyl)sulfanyl)copper, 2,2′-bipyridine; [(trifluoromethyl)sulfanyl]copper, 858-445-9, 1413732-47-4, (2,2′-bipyridine)Cu(SCF3), CS-0087081

This compound is primarily used as a catalyst or intermediate in organic synthesis, particularly in C-S bond-forming reactions. Its stability and reactivity make it suitable for photophysical applications and coordination chemistry studies. Researchers also employ it in the development of novel metal-organic frameworks (MOFs) and advanced materials. Its trifluoromethylsulfanyl moiety is valuable in pharmaceutical and agrochemical research.

Safety and Hazards

GHS Hazard Statements

• H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]
• H312 (50%): Harmful in contact with skin [Warning Acute toxicity, dermal]
• H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]
• H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]
• H335 (100%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposure; Respiratory tract irritation]
• H412 (50%): Harmful to aquatic life with long lasting effects [Hazardous to the aquatic environment, long-term hazard]

Precautionary Statements

• P261, P264, P264+P265, P270, P271, P273, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P317, P319, P321, P330, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501

Hazard Classes and Categories

• Acute Tox. 4 (100%)
• Acute Tox. 4 (50%)
• Skin Irrit. 2 (100%)
• Eye Irrit. 2 (100%)
• STOT SE 3 (100%)
• Aquatic Chronic 3 (50%)

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Disclaimer: Sold exclusively for laboratory research. Prohibited for commercial use, diagnostics, or human/animal applications. Buyers assume all compliance liability.