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Di-tert-butylneopentylphosphonium tetrafluoroborate

Catalog Number
ACM886059843-1
Product Name
Di-tert-butylneopentylphosphonium tetrafluoroborate
Structure
Di-tert-butylneopentylphosphonium tetrafluoroborate
CAS
886059-84-3
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Synonyms
C13H30BF4P; FT-0742387; MFCD08064039; Di-tert-butylneopentylphosphonium tetrafluoroborate; RT-012304; DB-020903; Di-tert-butyl (neopentyl)phosphonium tetrafluoroborate; Di-tert-butyl(2,2-dimethylpropyl)phosphanium tetrafluoroborate; 4427AC; CTK5G0899;
IUPAC Name
ditert-butyl(2,2-dimethylpropyl)phosphanium;tetrafluoroborate;
Molecular Weight
304.16g/mol
Molecular Formula
C13H30BF4P;
Canonical SMILES
[B-](F)(F)(F)F.CC(C)(C)C[PH+](C(C)(C)C)C(C)(C)C;
InChI
InChI=1S/C13H29P.BF4/c1-11(2,3)10-14(12(4,5)6)13(7,8)9;2-1(3,4)5/h10H2,1-9H3;/q;-1/p+1;
InChI Key
UWNPUGYQGIWNRI-UHFFFAOYSA-O;
Complexity
178
Covalently-Bonded Unit Count
2
Exact Mass
304.211g/mol
H-Bond Acceptor
5
Heavy Atom Count
19
Monoisotopic Mass
304.211g/mol
Rotatable Bond Count
4
Topological Polar Surface Area
0A^2
Application
The phosphine, used in combination with a palladium source and base, produces a highly effective catalyst for the Buchwald- Hartwig amination of aryl bromides at room temperature.

Phosphine used in the palladium-catalyzed, Suzuki cross-coupling reaction.

Phosphine used in the palladium-catalyze Kumada cross-coupling reaction.
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