CID 16006939

Base Information

• Chemical Name: CID 16006939
• CAS No.: 666826-16-0
• Molecular Formula: Ir(COD)2BARF
• Molecular Weight: 1271.81
• Hs Code.: 28439000
• European Community (EC) Number: 636-294-8
• Mol file: 666826-16-0.mol

Synonyms:666826-16-0;Bis(cyclooctadiene)iridium(I) tetrakis(3,5-bis(trifluoromethyl)phenyl)borate;MFCD10567389;Bis(1,5-cyclooctadiene)iridium tetrakis[3,5-bis(trifluoromethyl);Bis(cyclooctadiene)iridium(I) Tetrakis[3,5-bis(trifluoromethyl)phenyl]borate;YQXKTVMJDKWGHI-UHFFFAOYSA-N;SY068638;D94660;Cycloocta-1,5-diene;iridium;tetrakis[3,5-bis(trifluoromethyl)phenyl]boranuide

Chemical Property of CID 16006939

Chemical Property:

• PSA: 0.00000
• LogP: 16.56000
• Storage Temp.: under inert gas (nitrogen or Argon) at 2-8°C
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 25
• Rotatable Bond Count: 4
• Exact Mass: 1272.21561
• Heavy Atom Count: 74
• Complexity: 1120

Purity/Quality:

98%,99%, ^*data from raw suppliers

Bis(1,5-cyclooctadiene)iridium(I) tetrakis[3,5-bis(trifluoromethyl)phenyl]borate, 98% ^*data from reagent suppliers

Safty Information:

• Hazard Codes: Xi
• Statements: 36/37/38
• Safety Statements: 26

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: [B-](C1=CC(=CC(=C1)C(F)(F)F)C(F)(F)F)(C2=CC(=CC(=C2)C(F)(F)F)C(F)(F)F)(C3=CC(=CC(=C3)C(F)(F)F)C(F)(F)F)C4=CC(=CC(=C4)C(F)(F)F)C(F)(F)F.C1CC=CCCC=C1.C1CC=CCCC=C1.[Ir]
• Uses: Catalyst for:Asymmetric hydrogenation reactionsDirected cyclodehydration reactionDirect prenylation via C-H oxidative addition-allene insertionDouble intramolecular hydroalkoxylationIntramolecular hydroamination reactionsDirected C-H bond cleavageImine vinylation reactionsUmicore Precatalysts for Asymmetric and Cross-Coupling Catalysis