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Bis(4-fluorophenyl)phenylphosphine oxide

Catalog Number
ACM54300322
Product Name
Bis(4-fluorophenyl)phenylphosphine oxide
Structure
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CAS
54300-32-2
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Synonyms
bis(p-fluorophenyl)phenylphosphine oxide
IUPAC Name
1-fluoro-4-[(4-fluorophenyl)-phenylphosphoryl]benzene;
Molecular Weight
314.27
Molecular Formula
(FC6H4)2P(O)C6H5
Canonical SMILES
C1=CC=C(C=C1)P(=O)(C2=CC=C(C=C2)F)C3=CC=C(C=C3)F;
InChI
InChI=1S/C18H13F2OP/c19-14-6-10-17(11-7-14)22(21,16-4-2-1-3-5-16)18-12-8-15(20)9-13-18/h1-13H;
InChI Key
AAYLOGMTTMROGA-UHFFFAOYSA-N;
Boiling Point
454.5° C at 760 mmHg (Predicted)
Melting Point
125-131° C
Density
1.3 g/cm3(Predicted)
Storage
room temperature
Complexity
366
Covalently-Bonded Unit Count
1
Exact Mass
314.067g/mol
H-Bond Acceptor
3
Heavy Atom Count
22
Monoisotopic Mass
314.067g/mol
Rotatable Bond Count
3
Topological Polar Surface Area
17.1A^2
Application
Bis(4-fluorophenyl)phenylphosphine oxide serves multiple critical purposes across various applications. It acts as a catalyst in hydroformylation reactions, facilitating the addition of formyl groups to unsaturated hydrocarbons, which is crucial in producing aldehydes. Additionally, it plays a key role in creating chlorine-tolerant polymers, essential for desalination processes where durability against chlorine exposure is paramount. Furthermore, this compound is utilized as a crosslinking agent in the development of polymer electrolyte membranes for fuel cells, enhancing their stability and performance, thus contributing to more efficient energy systems.
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