ChemicalBook--->CAS DataBase List--->63936-85-6

63936-85-6

63936-85-6 Structure

63936-85-6 Structure
IdentificationBack Directory
[Name]

Chloro(1,5-cyclooctadiene)methylpalladium(II) 97%
[CAS]

63936-85-6
[Synonyms]

ChloroMethyl(1
Cyclooctadienylmethylpalladium chloride
Chloro(1,5-cyclooctadiene)methylpalladium(II) 97%
Chloro(1,5-cyclooctadiene)MethylpalladiuM(II),97%
CHLOROMETHYL(1,5-CYCLOOCTADIENE)PALLADIUM(II),99%
ChloroMethyl(1,5-cyclooctadiene)palladiuM(II), 99%
Carbanide,chloropalladium(1+),(1Z,5Z)-cycloocta-1,5-diene
[Molecular Formula]

C9H14ClPd+
[MDL Number]

MFCD16621448
[MOL File]

63936-85-6.mol
[Molecular Weight]

264
Chemical PropertiesBack Directory
[Melting point ]

124-129 °C
[Fp ]

97℃
[storage temp. ]

-20°C, stored under nitrogen
[form ]

Powder
[color ]

light grey
[Sensitive ]

air sensitive, store cold
[InChI]

1S/C8H12.CH3.ClH.Pd/c1-2-4-6-8-7-5-3-1;;;/h1-2,7-8H,3-6H2;1H3;1H;/q;;;+1/p-1/b2-1-,8-7-;;;
[InChIKey]

PPNGAOYQLFBHIK-PHFPKPIQSA-M
[SMILES]

C[Pd]Cl.C1CC=CCCC=C1
Safety DataBack Directory
[Symbol(GHS) ]

Skull and Crossbones (GHS06)Health Hazard (GHS08)Environment (GHS09)
GHS06,GHS08,GHS09
[Signal word ]

Danger
[Hazard statements ]

H301-H310-H315-H319-H332-H335-H372-H411
[Precautionary statements ]

P262-P273-P280-P301+P310+P330-P302+P352+P310-P304+P340+P312
[Hazard Codes ]

T+,N
[Risk Statements ]

26/27/28-36/37/38-48/23/25-50/53
[Safety Statements ]

26-28-36/37-45-61
[RIDADR ]

UN2811 - class 6.1 - PG 3 - EHS - Toxic solids, organic, n.o.s., HI: all
[WGK Germany ]

3
[Storage Class]

6.1A - Combustible acute toxic Cat. 1 and 2
very toxic hazardous materials
[Hazard Classifications]

Acute Tox. 2 Dermal
Acute Tox. 3 Oral
Acute Tox. 4 Inhalation
Aquatic Chronic 2
Eye Irrit. 2
Skin Irrit. 2
STOT RE 1
STOT SE 3
Hazard InformationBack Directory
[Chemical Properties]

Chloro(1,5-cyclooctadiene)methylpalladium(II) has a white color that gradually changes to yellow and brown. It is soluble in organic solvents such as dichloromethane, benzene, and diethyl ether. Its physicochemical properties are unstable and easily change when exposed to air, light, moisture, and heat.
[Uses]

Catalyst for:
  • Addition polymerization reactions
  • Double carbonylation
  • Cyclization
  • Cyclometalation
[reaction suitability]

core: palladium
reaction type: Buchwald-Hartwig Cross Coupling Reaction
reaction type: Cross Couplings
reaction type: Heck Reaction
reaction type: Hiyama Coupling
reaction type: Negishi Coupling
reaction type: Sonogashira Coupling
reaction type: Stille Coupling
reaction type: Suzuki-Miyaura Coupling
reagent type: catalyst
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