Product Name

  • Name

    1,4-Bis(diphenylphosphino)butane-palladium(II) chloride

  • EINECS 243-231-4
  • CAS No. 29964-62-3
  • Article Data16
  • CAS DataBase
  • Density
  • Solubility
  • Melting Point 285-305 °C
  • Formula C28H28Cl2P2Pd
  • Boiling Point 542°C at 760 mmHg
  • Molecular Weight 603.804
  • Flash Point 299.5°C
  • Transport Information
  • Appearance yellow solid
  • Safety 24/25
  • Risk Codes 36/37/38
  • Molecular Structure Molecular Structure of 29964-62-3 (1,4-Bis(diphenylphosphino)butane-palladium(II) chloride)
  • Hazard Symbols HarmfulXn
  • Synonyms Palladium,[1,4-butanediylbis[diphenylphosphine]-P,P']dichloro-, (SP-4-2)-;Palladium,dichloro[tetramethylenebis[diphenylphosphine]]- (8CI);Palladium,[1,4-butanediylbis[diphenylphosphine-kP]]dichloro-, (SP-4-2)- (9CI);Phosphine,1,4-butanediylbis[diphenyl-, palladium complex;(1,4-Bis(diphenylphosphino)butane)palladium dichloride;1,4-Butylenebis(diphenylphosphine)palladium dichloride;Dichloro[1,4-bis(diphenylphosphino)butane]palladium;Dichloro[1,4-bis(diphenylphosphino)butane]palladium (II);[1,4-Bis(diphenylphosphino)butane]dichloropalladium;[1,4-Bis(diphenylphosphino)butane]palladium(II)dichloride;
  • PSA 27.18000
  • LogP 7.41140

Synthetic route

hydrogenchloride
7647-01-0

hydrogenchloride

palladium
7440-05-3

palladium

1,4-di(diphenylphosphino)-butane
7688-25-7

1,4-di(diphenylphosphino)-butane

[1,4-bis(diphenylphosphino)butane] palladium(ll) dichloride
29964-62-3

[1,4-bis(diphenylphosphino)butane] palladium(ll) dichloride

Conditions
ConditionsYield
Stage #1: hydrogenchloride; palladium With nitric acid In water
Stage #2: 1,4-di(diphenylphosphino)-butane In water; N,N-dimethyl-formamide at 50℃; for 1h;
98.9%
dichloro bis(acetonitrile) palladium(II)
21264-30-2, 90243-59-7, 14592-56-4

dichloro bis(acetonitrile) palladium(II)

1,4-di(diphenylphosphino)-butane
7688-25-7

1,4-di(diphenylphosphino)-butane

[1,4-bis(diphenylphosphino)butane] palladium(ll) dichloride
29964-62-3

[1,4-bis(diphenylphosphino)butane] palladium(ll) dichloride

Conditions
ConditionsYield
In benzene at 110℃; for 48h; Schlenk technique; Inert atmosphere;97%
In 1,2-dichloro-ethane N2-atmosphere; stirring (room temp., 24 h); concg. (reduced pressure), filtering, washing (Et2O), drying (vac.); elem. anal.;94%
sodium tetrachloropalladate(II)

sodium tetrachloropalladate(II)

1,4-di(diphenylphosphino)-butane
7688-25-7

1,4-di(diphenylphosphino)-butane

[1,4-bis(diphenylphosphino)butane] palladium(ll) dichloride
29964-62-3

[1,4-bis(diphenylphosphino)butane] palladium(ll) dichloride

Conditions
ConditionsYield
In tetrahydrofuran; ethanol stirring for 2 h; evapn., washing with H2O, drying at 80°C for 12 h;88%
bis(benzonitrile)palladium(II) dichloride
15617-18-2, 39958-10-6, 14220-64-5

bis(benzonitrile)palladium(II) dichloride

1,4-di(diphenylphosphino)-butane
7688-25-7

1,4-di(diphenylphosphino)-butane

[1,4-bis(diphenylphosphino)butane] palladium(ll) dichloride
29964-62-3

[1,4-bis(diphenylphosphino)butane] palladium(ll) dichloride

Conditions
ConditionsYield
elem. anal.;83%
In not given
In ethanol; dichloromethane
In toluene at 20℃; for 0.5h; Inert atmosphere;
In toluene at 20℃; for 0.5h; Inert atmosphere;
dichloro-(1,2-dimethoxy-4,5-bis(2-pyridylethynyl)benzene)palladium
570397-18-1

dichloro-(1,2-dimethoxy-4,5-bis(2-pyridylethynyl)benzene)palladium

1,4-di(diphenylphosphino)-butane
7688-25-7

1,4-di(diphenylphosphino)-butane

[1,4-bis(diphenylphosphino)butane] palladium(ll) dichloride
29964-62-3

[1,4-bis(diphenylphosphino)butane] palladium(ll) dichloride

Conditions
ConditionsYield
In dimethyl sulfoxide room temp., 30 min; monitored by (1)H NMR;75%
1,4-di(diphenylphosphino)-butane
7688-25-7

1,4-di(diphenylphosphino)-butane

palladium dichloride

palladium dichloride

[1,4-bis(diphenylphosphino)butane] palladium(ll) dichloride
29964-62-3

[1,4-bis(diphenylphosphino)butane] palladium(ll) dichloride

Conditions
ConditionsYield
In acetonitrile stirring (70°C, 2 h), partial solvent evapn. (1/5); recrystn. (dimethylformamide), drying (vacuum); elem. anal.;61.4%
In dimethyl sulfoxide prepn. according to: A. Westland, J. Chem. Soc., (1965) 3060; ligand is mixed with PdCl2 in DMSO and heated at 100°C until a clear soln. is obtained; cooling down, filtration, washing with pentane;>90
dichloro(cycloocta-1,5-diene)palladium (II)
12107-56-1

dichloro(cycloocta-1,5-diene)palladium (II)

1,4-di(diphenylphosphino)-butane
7688-25-7

1,4-di(diphenylphosphino)-butane

[1,4-bis(diphenylphosphino)butane] palladium(ll) dichloride
29964-62-3

[1,4-bis(diphenylphosphino)butane] palladium(ll) dichloride

Conditions
ConditionsYield
In dichloromethane under N2, addn. of complex in CH2Cl2 to soln. of ligand in CH2Cl2, stirred for 25°C for 2 h, white pptn.; evapd. under reduced press., addn. of toluene, heated under reflux for 4 h, pptn., filtered, dried in vac.;
[1,4-bis(diphenylphosphino)butane] palladium(ll) dichloride
29964-62-3

[1,4-bis(diphenylphosphino)butane] palladium(ll) dichloride

dichloromethane
75-09-2

dichloromethane

silver trifluoromethanesulfonate
2923-28-6

silver trifluoromethanesulfonate

[Pd(1,4-bis(diphenylphosphino)butane)(H2O)2][OTf]2*CH2Cl2

[Pd(1,4-bis(diphenylphosphino)butane)(H2O)2][OTf]2*CH2Cl2

Conditions
ConditionsYield
In dichloromethane under N2 atm. to suspn. Pd(dppb)Cl2 in CH2Cl2 AgOTf was added and stirred at room temp. for 24 h with exclusion light; soln. was filtered in air and concd. in vacuo, Et2O was added, ppt. was washed with Et2O and dried in vacuo; elem. anal.;96%
[1,4-bis(diphenylphosphino)butane] palladium(ll) dichloride
29964-62-3

[1,4-bis(diphenylphosphino)butane] palladium(ll) dichloride

bis(N,N-diethyldithiocarbamato)mercury(II)
14239-51-1

bis(N,N-diethyldithiocarbamato)mercury(II)

dichloromethane
75-09-2

dichloromethane

(N,N-diethyldithiocarbamato)[bis(diphenylphosphino)butane]palladium(II) tetrachloromercurate(II)*0.5CH2Cl2

(N,N-diethyldithiocarbamato)[bis(diphenylphosphino)butane]palladium(II) tetrachloromercurate(II)*0.5CH2Cl2

Conditions
ConditionsYield
In dichloromethane stirred for 1 h; filtered, soln. concd. (vac.), pptd. (diethyl ether), ppt. filtered, washed (diethyl ether), dried (vac., 3 h), recrystd. (CH2Cl2); elem. anal.;94%
[1,4-bis(diphenylphosphino)butane] palladium(ll) dichloride
29964-62-3

[1,4-bis(diphenylphosphino)butane] palladium(ll) dichloride

cadmium(II) diethyldithiocarbamate
14239-68-0

cadmium(II) diethyldithiocarbamate

(N,N-diethyldithiocarbamato)[bis(diphenylphosphino)butane]palladium(II) tetrachlorocadmate(II)

(N,N-diethyldithiocarbamato)[bis(diphenylphosphino)butane]palladium(II) tetrachlorocadmate(II)

Conditions
ConditionsYield
In dichloromethane stirred for 1 h; filtered, soln. concd. (vac.), pptd. (diethyl ether), ppt. filtered, washed (diethyl ether), dried (vac., 3 h), recrystd. (CH2Cl2); elem. anal.;94%
[1,4-bis(diphenylphosphino)butane] palladium(ll) dichloride
29964-62-3

[1,4-bis(diphenylphosphino)butane] palladium(ll) dichloride

bis(N,N-diethyldithiocarbamato)zinc(II)
14324-55-1

bis(N,N-diethyldithiocarbamato)zinc(II)

dichloromethane
75-09-2

dichloromethane

(N,N-diethyldithiocarbamato)[bis(diphenylphosphino)butane]palladium(II) tetrachlorozincate(II)*0.5CH2Cl2

(N,N-diethyldithiocarbamato)[bis(diphenylphosphino)butane]palladium(II) tetrachlorozincate(II)*0.5CH2Cl2

Conditions
ConditionsYield
In dichloromethane stirred for 1 h; filtered, soln. concd. (vac.), pptd. (diethyl ether), ppt. filtered, washed (diethyl ether), dried (vac., 3 h), recrystd. (CH2Cl2); elem. anal.;93%
[1,4-bis(diphenylphosphino)butane] palladium(ll) dichloride
29964-62-3

[1,4-bis(diphenylphosphino)butane] palladium(ll) dichloride

bis(N,N-diethyldithiocarbamate)lead
17549-30-3

bis(N,N-diethyldithiocarbamate)lead

dichloromethane
75-09-2

dichloromethane

(N,N-diethyldithiocarbamato)[bis(diphenylphosphino)butane]palladium(II) tetrachloroplumbate(II)*0.5CH2Cl2

(N,N-diethyldithiocarbamato)[bis(diphenylphosphino)butane]palladium(II) tetrachloroplumbate(II)*0.5CH2Cl2

Conditions
ConditionsYield
In dichloromethane stirred for 1 h; filtered, soln. concd. (vac.), pptd. (diethyl ether), ppt. filtered, washed (diethyl ether), dried (vac., 3 h), recrystd. (CH2Cl2); elem. anal.;93%
silver tetrafluoroborate
14104-20-2

silver tetrafluoroborate

[1,4-bis(diphenylphosphino)butane] palladium(ll) dichloride
29964-62-3

[1,4-bis(diphenylphosphino)butane] palladium(ll) dichloride

[(1,4-bis(diphenylphosphinobutane))Pd(μ-OH)]2(BF4)2

[(1,4-bis(diphenylphosphinobutane))Pd(μ-OH)]2(BF4)2

Conditions
ConditionsYield
In dichloromethane; acetone byproducts: AgCl; N2-atmosphere; stirring (dark, 1 h); filtering, concg. (reduced pressure), pptn. on Et2O addn., filtering, washing (Et2O), drying. (vac.); elem. anal.;92%
[1,4-bis(diphenylphosphino)butane] palladium(ll) dichloride
29964-62-3

[1,4-bis(diphenylphosphino)butane] palladium(ll) dichloride

1-Phenyl-1H-tetrazole-5-thiol
86-93-1

1-Phenyl-1H-tetrazole-5-thiol

[Pd(κ1-S-ppt)2(κ2-1,4-bis(diphenylphosphino)butane)]

[Pd(κ1-S-ppt)2(κ2-1,4-bis(diphenylphosphino)butane)]

Conditions
ConditionsYield
With sodium hydroxide In ethanol; chloroform for 2h; Reflux;78%
[1,4-bis(diphenylphosphino)butane] palladium(ll) dichloride
29964-62-3

[1,4-bis(diphenylphosphino)butane] palladium(ll) dichloride

silver trifluoromethanesulfonate
2923-28-6

silver trifluoromethanesulfonate

acetonitrile
75-05-8

acetonitrile

C32H34N2P2Pd(2+)*2CF3O3S(1-)

C32H34N2P2Pd(2+)*2CF3O3S(1-)

Conditions
ConditionsYield
at 20℃; Schlenk technique; Inert atmosphere;77%
[1,4-bis(diphenylphosphino)butane] palladium(ll) dichloride
29964-62-3

[1,4-bis(diphenylphosphino)butane] palladium(ll) dichloride

silver trifluoromethanesulfonate
2923-28-6

silver trifluoromethanesulfonate

Pd(1,2-bis(diphenylphosphino)butane)(OSO2CF3)2
143848-70-8, 320635-25-4

Pd(1,2-bis(diphenylphosphino)butane)(OSO2CF3)2

Conditions
ConditionsYield
In tetrahydrofuran under N2, addn. of 2 equiv. AgSO3CF3 to suspn. of Pd-complex in THF; filtration after 24 h, evapn. (vac.), recrystn. (CH2Cl2/Et2O), elem. anal.;58%
In not given
[1,4-bis(diphenylphosphino)butane] palladium(ll) dichloride
29964-62-3

[1,4-bis(diphenylphosphino)butane] palladium(ll) dichloride

1,4-dilithiobutane
2123-72-0

1,4-dilithiobutane

{1,4-bis(diphenylphosphino)butane}(butane-1,4-diyl)palladium(II)

{1,4-bis(diphenylphosphino)butane}(butane-1,4-diyl)palladium(II)

Conditions
ConditionsYield
In diethyl ether mixt. of the Pd compound and 1,4-dilithiobutane in Et2O stirred for 1 h at -78°C, then at room temp. for 3 h; solid sepd. from the soln., dried in vac. and extd. with toluene; soln. filtered and concd.; addn. of pentane to the filtrate, cooling to -30°C; elem. anal.;23%
[1,4-bis(diphenylphosphino)butane] palladium(ll) dichloride
29964-62-3

[1,4-bis(diphenylphosphino)butane] palladium(ll) dichloride

tetramethylammonium octahydrotriborate
12386-10-6

tetramethylammonium octahydrotriborate

(1,4-bis(diphenylphosphino)butane)palladium(II)B3H7

(1,4-bis(diphenylphosphino)butane)palladium(II)B3H7

Conditions
ConditionsYield
With triethylamine In toluene; acetonitrile byproducts: {(CH3)4N}Cl, (C2H5)3N*B3H7, (C2H5)3N*BH3; under argon, stirring for 3 h, then standing for 1 h; further by-products: Et3NHCl, BH3*PPh2CH2CH2CH2CH2PPh2*BH3;; evapn. of the solvent in vac., chromy. (kieselgel 70-230 mesh, hexane);;5%
silver tetrafluoroborate
14104-20-2

silver tetrafluoroborate

[1,4-bis(diphenylphosphino)butane] palladium(ll) dichloride
29964-62-3

[1,4-bis(diphenylphosphino)butane] palladium(ll) dichloride

acetonitrile
75-05-8

acetonitrile

{(1,4-bis(diphenylphosphino)butane)Pd(NCMe)2}(BF4)2

{(1,4-bis(diphenylphosphino)butane)Pd(NCMe)2}(BF4)2

Conditions
ConditionsYield
In dichloromethane; acetonitrile byproducts: AgCl; prepn. according to: Pisiano, C., Consiglio, G., Sirioni, A. & Moret, M., J. Chem. Soc., Chem. Commun., (1991) 421. mixing of suspn. of Pd-compd. in CH2Cl2 and AgBF4 in MeCN, stirring for some min; AgCl is filtered off;
[1,4-bis(diphenylphosphino)butane] palladium(ll) dichloride
29964-62-3

[1,4-bis(diphenylphosphino)butane] palladium(ll) dichloride

methyllithium
917-54-4

methyllithium

cis-dimethylbis(PPh2C4H8PPh2)palladium(II)
113530-47-5

cis-dimethylbis(PPh2C4H8PPh2)palladium(II)

Conditions
ConditionsYield
In diethyl ether
[1,4-bis(diphenylphosphino)butane] palladium(ll) dichloride
29964-62-3

[1,4-bis(diphenylphosphino)butane] palladium(ll) dichloride

ethyllithium
811-49-4

ethyllithium

cis-diethyl-1,4-bis(diphenylphosphino)butane-palladium
96644-75-6

cis-diethyl-1,4-bis(diphenylphosphino)butane-palladium

Conditions
ConditionsYield
In diethyl ether
[1,4-bis(diphenylphosphino)butane] palladium(ll) dichloride
29964-62-3

[1,4-bis(diphenylphosphino)butane] palladium(ll) dichloride

silver trifluoromethanesulfonate
2923-28-6

silver trifluoromethanesulfonate

Pd(C6H5)2PC4H8P(C6H5)2(CF3SO3)(1+)*CF3SO3(1-)=Pd((C6H5)2PC4H8P(C6H5)2)(CF3SO3)2
320635-25-4, 143848-70-8

Pd(C6H5)2PC4H8P(C6H5)2(CF3SO3)(1+)*CF3SO3(1-)=Pd((C6H5)2PC4H8P(C6H5)2)(CF3SO3)2

Conditions
ConditionsYield
In not given byproducts: AgCl;
[1,4-bis(diphenylphosphino)butane] palladium(ll) dichloride
29964-62-3

[1,4-bis(diphenylphosphino)butane] palladium(ll) dichloride

silver trifluoromethanesulfonate
2923-28-6

silver trifluoromethanesulfonate

[Pd(μ-Cl)(Ph2P(CH2)4PPh2)]2[TfO]2

[Pd(μ-Cl)(Ph2P(CH2)4PPh2)]2[TfO]2

Conditions
ConditionsYield
In not given
tetrahydrofuran
109-99-9

tetrahydrofuran

[1,4-bis(diphenylphosphino)butane] palladium(ll) dichloride
29964-62-3

[1,4-bis(diphenylphosphino)butane] palladium(ll) dichloride

silver perchlorate

silver perchlorate

Pd(C6H5)2PC4H8P(C6H5)2(C4H8O)2(2+)*2ClO4(1-)=Pd((C6H5)2PC4H8P(C6H5)2)(C4H8O)2(ClO4)2

Pd(C6H5)2PC4H8P(C6H5)2(C4H8O)2(2+)*2ClO4(1-)=Pd((C6H5)2PC4H8P(C6H5)2)(C4H8O)2(ClO4)2

Conditions
ConditionsYield
In tetrahydrofuran byproducts: AgCl;
[1,4-bis(diphenylphosphino)butane] palladium(ll) dichloride
29964-62-3

[1,4-bis(diphenylphosphino)butane] palladium(ll) dichloride

silver perchlorate

silver perchlorate

acetonitrile
75-05-8

acetonitrile

Pd(C6H5)2PC4H8P(C6H5)2(CH3CN)2(2+)*2ClO4(1-)=Pd((C6H5)2PC4H8P(C6H5)2)(CNCH3)2(ClO4)2

Pd(C6H5)2PC4H8P(C6H5)2(CH3CN)2(2+)*2ClO4(1-)=Pd((C6H5)2PC4H8P(C6H5)2)(CNCH3)2(ClO4)2

Conditions
ConditionsYield
In acetonitrile byproducts: AgCl;
[1,4-bis(diphenylphosphino)butane] palladium(ll) dichloride
29964-62-3

[1,4-bis(diphenylphosphino)butane] palladium(ll) dichloride

ammonium tetrathiotungstate
13862-78-7

ammonium tetrathiotungstate

water
7732-18-5

water

N,N-dimethyl-formamide
68-12-2, 33513-42-7

N,N-dimethyl-formamide

[1,4-bis(diphenylphosphino)butane-2κ2P,P']di-μ-thio-1:2κ4S-dithio-1κ2S-palladium(II)tungsten(VI) N,N'-dimethylformamide hemisolvate hemihydrate

[1,4-bis(diphenylphosphino)butane-2κ2P,P']di-μ-thio-1:2κ4S-dithio-1κ2S-palladium(II)tungsten(VI) N,N'-dimethylformamide hemisolvate hemihydrate

Conditions
ConditionsYield
In dichloromethane; acetonitrile Pd-comp. and W-comp. added to CH2Cl2-CH3CN mixture, 1:1, v/v, stirred for 20 h; filtered, washed with CH2Cl2, distilled H2O, anhydrous EtOH and ether, elem. anal.;
[1,4-bis(diphenylphosphino)butane] palladium(ll) dichloride
29964-62-3

[1,4-bis(diphenylphosphino)butane] palladium(ll) dichloride

sale sodico del 1,2-benzisotiazolin-3-one
58249-25-5

sale sodico del 1,2-benzisotiazolin-3-one

[Pd(benzisothiazolinate)2(1,4-bis(diphenylphosphino)butane)2]

[Pd(benzisothiazolinate)2(1,4-bis(diphenylphosphino)butane)2]

[PdCl(benzisothiazolinate)2(k2-1,4-bis(diphenylphosphino)butane)2]

[PdCl(benzisothiazolinate)2(k2-1,4-bis(diphenylphosphino)butane)2]

Conditions
ConditionsYield
In ethanol; dichloromethane for 3h; Heating; Overall yield = 78 %; Overall yield = 0.062 g;

1,4-Bis(diphenylphosphino)butane-palladium(II) chloride Chemical Properties

Empirical Formula: C28H29ClP2Pd
Molecular Weight: 569.3504g/mol
EINECS: 243-231-4 
Structure of 1,4-Bis(diphenylphosphino)butane-palladium(II) chloride (CAS NO.29964-62-3):

Physical Appearance: yellow solid
Product Categories: Metal Compounds;Catalysts for Organic Synthesis;Classes of Metal Compounds;Homogeneous Catalysts;Metal Complexes;Pd (Palladium) Compounds;Synthetic Organic Chemistry;Transition Metal Compounds 
Systematic Name: (diphenylphosphanyl)palladium(1+) chloride - (1-methylpropyl)(diphenyl)phosphane (1:1)
SMILES: [Cl-].[Pd+]P(c1ccccc1)c2ccccc2.CC(CC)P(c1ccccc1)c2ccccc2
InChI: InChI=1/C16H19P.C12H10P.ClH.Pd/c1-3-14(2)17(15-10-6-4-7-11-15)16-12-8-5-9-13-16;1-3-7-11(8-4-1)13-12-9-5-2-6-10-12;;/h4-14H,3H2,1-2H3;1-10H;1H;/q;-1;;+2/p-1/rC16H19P.C12H10PPd.ClH/c1-3-14(2)17(15-10-6-4-7-11-15)16-12-8-5-9-13-16;14-13(11-7-3-1-4-8-11)12-9-5-2-6-10-12;/h4-14H,3H2,1-2H3;1-10H;1H/q;+1;/p-1 InChIKey: WCTRMVZCSUMBIZ-CTPBABKZAY

1,4-Bis(diphenylphosphino)butane-palladium(II) chloride Safety Profile

Hazard Codes: HarmfulXn
Safety Statements: 24/25
S24/25:Avoid contact with skin and eyes.
WGK Germany: 3
F: 1-10

1,4-Bis(diphenylphosphino)butane-palladium(II) chloride Specification

  1,4-Bis(diphenylphosphino)butane-palladium(II) chloride , its cas register number is 29964-62-3. It also can be called (Diphenylphosphino)palladium(1+) chloride - sec-butyl(diphenyl)phosphine (1:1:1) ; Palladium(II) chloride-1,4-bis(diphenylphosphine)butane . You should avoid contact 1,4-Bis(diphenylphosphino)butane-palladium(II) chloride (CAS NO.29964-62-3) with skin and eyes.

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