227005-28-9

Basic information

• Product Name: CH₃C[CH₂P(C₆H₅)2]3IrH₂(C₈SH₈)⁽¹⁺⁾*B(C₆H₅)4^(1-)=CH₃C[CH₂P(C₆H₅)2]3IrH₂(C₈SH₈)B(C₆H₅)4
• Synonyms: CH₃C[CH₂P(C₆H₅)2]3IrH₂(C₈SH₈)⁽¹⁺⁾*B(C₆H₅)4^(1-)=CH₃C[CH₂P(C₆H₅)2]3IrH₂(C₈SH₈)B(C₆H₅)4
• CAS NO: 227005-28-9
• Molecular Weight: 1274.37
• Mol File: 227005-28-9.mol
• Article Data: 1

Chemical Properties

• CAS DataBase Reference: CH₃C[CH₂P(C₆H₅)2]3IrH₂(C₈SH₈)⁽¹⁺⁾*B(C₆H₅)4^(1-)=CH₃C[CH₂P(C₆H₅)2]3IrH₂(C₈SH₈)B(C₆H₅)4(CAS DataBase Reference)
• NIST Chemistry Reference: CH₃C[CH₂P(C₆H₅)2]3IrH₂(C₈SH₈)⁽¹⁺⁾*B(C₆H₅)4^(1-)=CH₃C[CH₂P(C₆H₅)2]3IrH₂(C₈SH₈)B(C₆H₅)4(227005-28-9)
• EPA Substance Registry System: CH₃C[CH₂P(C₆H₅)2]3IrH₂(C₈SH₈)⁽¹⁺⁾*B(C₆H₅)4^(1-)=CH₃C[CH₂P(C₆H₅)2]3IrH₂(C₈SH₈)B(C₆H₅)4(227005-28-9)

Safety Data

• Hazardous Substances Data: 227005-28-9(Hazardous Substances Data)

Upstream product

• 4565-32-6 2,3-dihydrobenzo(b)thiophene 
• 142928-68-5 [(1,1,1-tris(diphenylphosphinomethyl)ethane)Ir(H)2(THF)]BPh₄ 

Downstream Products

• 227005-29-0 CH₃C[CH₂P(C₆H₅)2]3IrH₂(SC₆H₄CHCH₂) 

Relevant articles and documents

First example of opening and hydrogenation of 2,3-dihydrobenzo[b]thiophene to 2-ethylthiophenol assisted by a soluble metal complex

Displacement of THF by dihydrobenzo[b]thiophene (DHBT) in [(triphos)Ir(H)2(THF)]BPh4 yields the η1-S-DHBT adduct [(triphos)Ir(H)2(η1-DHBT)]BPh4 which reacts in THF at room temperature with KOBu(t) to give the neutral 2-vinylthiophenolate derivative (triphos)Ir(H)2{η1-o-S(C6H4)CH=CH2} via C2-S bond cleavage; the latter compound is hydrogenated under mild conditions (2 bar H2, 80°C) to the 2-ethylthiophenolate derivative (triphos)Ir(H)2{o-S(C6H4)Et} and under harsh conditions (30 bar H2, 160°C) to free 2-ethylthiophenol and (triphos)IrH3.