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Bis[di-tert-butyl(4-dimethylaminophenyl)phosphine]palladium(0)

Catalog Number
ACM1233717684-1
Product Name
Bis[di-tert-butyl(4-dimethylaminophenyl)phosphine]palladium(0)
CAS
1233717-68-4
  • Product Overview
  • Usage
Synonyms
4-Ditert-butylphosphanyl-N,N-dimethylaniline;palladium
IUPAC Name
4-ditert-butylphosphanyl-N,N-dimethylaniline;palladium;
Molecular Weight
637.2
Molecular Formula
C32H56N2P2Pd
Canonical SMILES
CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C.CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C.[Pd]
InChI
InChI=1S/2C16H28NP.Pd/c2*1-15(2,3)18(16(4,5)6)14-11-9-13(10-12-14)17(7)8;/h2*9-12H,1-8H3;
InChI Key
SSPOQURGNAWORH-UHFFFAOYSA-N
Purity
95%+
Appearance
Powder
Complexity
237
Covalently-Bonded Unit Count
3
Exact Mass
636.29535
H-Bond Acceptor
2
Heavy Atom Count
37
Monoisotopic Mass
636.29535
Rotatable Bond Count
8
Topological Polar Surface Area
6.5 Ų
Application
The purpose of Bis[di-tert-butyl(4-dimethylaminophenyl)phosphine]palladium(0) is to act as a catalyst in various cross-coupling reactions, including sp2-sp3 couplings, such as Suzuki, Negishi-type, Heck, Sonogashira, and Buchwald-Hartwig reactions. It is particularly useful for facilitating the Heck alkynylation of aryl and heteroaryl chlorides, enhancing the efficiency and outcome of these chemical processes.
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