(acetyloxy)palladio acetate

• ChemBase ID: 140453
• Molecular Formular: C4H6O4Pd
• Molecular Mass: 224.50804
• Monoisotopic Mass: 223.93009467
• SMILES: CC(=O)O[Pd]OC(=O)C
• Canonical SMILES: CC(=O)O[Pd]OC(=O)C
• InChI: InChI=1S/2C2H4O2.Pd/c2*1-2(3)4;/h2*1H3,(H,3,4);/q;;+2/p-2
• InChIKey: YJVFFLUZDVXJQI-UHFFFAOYSA-L

NAMES AND DATABASE IDS

Names

• IUPAC name: (acetyloxy)palladio acetate
• IUPAC Traditional name: (acetyloxy)palladio acetate
• Synonyms: Pd(OAc)2; Palladium(II) acetate; ChemDose™, Palladium(II) acetate tablets; Palladium(II) acetate impregnated tablets; Pd(OAc)2 impregnated tablets; Palladium(II) acetate, ChemDose™ tablets; Palladium(II) acetate, recrystallized; 乙酸钯(II); ChemDose™，乙酸钯(II) 片剂; Pd(OAc)2 浸渍片剂; 乙酸钯(II) 浸渍片剂; 乙酸钯(II)，ChemDose™ 片剂; 重结晶乙酸钯(II)

Database IDs

• CAS Number: 3375-31-3
• EC Number: 222-164-4
• MDL Number: MFCD00012453
• Beilstein Number: 6086766
• PubChem SID: 162234697; 24885841; 24852356; 24863696; 24874166
• PubChem CID: 4144353

CALCULATED PROPERTIES

• H Acceptors: 2
• H Donor: 0
• LogD (pH = 5.5): -0.1134
• LogD (pH = 7.4): -0.1134
• Log P: -0.1134
• Molar Refractivity: 23.4322 cm^3
• Polarizability: 14.697714 Å^3
• Polar Surface Area: 52.6 Å^2
• Rotatable Bonds: 4
• Lipinski's Rule of Five: true

PROPERTIES

Physical Property

• Apperance: powder
• Melting Point: 216.3-223.7 °C (dec.); 227-231 °C

Safety Information

• RTECS: AJ1900000
• European Hazard Symbols: Corrosive (C); Irritant (Xi); Harmful (Xn)
• German water hazard class: 2; 3
• Risk Statements: 35; 40-41; 41
• Safety Statements: 26-36/37/39; 26-36/37/39-45; 26-39
• GHS Pictograms: GHS05; GHS08
• GHS Signal Word: Danger
• GHS Hazard statements: H314-H361d; H318; H318-H351
• GHS Precautionary statements: P280-P305 + P351 + P338; P280-P305 + P351 + P338-P310
• Personal Protective Equipment: dust mask type N95 (US), Eyeshields, Gloves

Product Information

• Purity: ≥99.9% trace metals basis; 47% Pd basis; 97%; 98%; 99.98% trace metals basis
• Grade: purum; reagent grade
• Matrix: Magnesium aluminometasilicate base material; Magnesium aluminometasilicate particle platform
• Linear Formula: Pd(OCOCH3)2

DETAILS

Sigma Aldrich - 720070

Packaging
1 g in glass bottle

Sigma Aldrich - 379875

Frequently Asked Questions
Live Chat and Frequently Asked Questions are available for this Product.
Application
A non-halogenated palladium(II) complex. It has been used as a catalyst for coupling reactions1 and as a precursor to prepare palladium-containing materials for heterogeneous catalysis.2,3
Application Guide for Palladium Catalyzed Cross-Coupling Reactions
Packaging
1, 5 g in poly bottle

Sigma Aldrich - 520764

Frequently Asked Questions
Live Chat and Frequently Asked Questions are available for this Product.
Packaging
1, 5, 25 g in glass bottle
Application

• Catalyst for formation of allylic acetates (eq. 1)
• Catalyst for hydroselenation of triple bonds (eq. 2)
• Catalyst for the Heck arylation of alkenes (eq. 3)
• Catalyst for cyclocarbonylation (eq. 4)
• Catalyst for Buchwald-Hartwig amination reaction (eq. 5)
Application Guide for Palladium Catalyzed Cross-Coupling Reactions

Sigma Aldrich - 683124

Packaging
5 g in glass bottle
500 mg in glass bottle
Legal Information
Product of Umicore
Application
Umicore Precatalysts for Asymmetric and Cross-Coupling Catalysis
Application Guide for Palladium Catalyzed Cross-Coupling Reactions

Sigma Aldrich - 684929

Frequently Asked Questions
Live Chat and Frequently Asked Questions are available for this Product.
Packaging
10, 100 tablets in glass bottle
Application
ChemDose: Convenient Dosing of Catalysts and Reagents
Legal Information
ChemDose is a trademark of Reaxa Ltd.

Sigma Aldrich - 76044

Other Notes
Review1,2
Application
Application Guide for Palladium Catalyzed Cross-Coupling Reactions

Sigma Aldrich - 205869

Application
Catalyst for an intramolecular coupling of aryl bromides with alcohols giving 1,3-oxazepines.1 Preparation of cyclic ureas via palladium-catalyzed intramolecular cyclization.2
Application Guide for Palladium Catalyzed Cross-Coupling Reactions
Packaging
1, 2, 10, 25 g in glass bottle

Sigma Aldrich - 685593

Frequently Asked Questions
Live Chat and Frequently Asked Questions are available for this Product.
Application
ChemDose: Convenient Dosing of Catalysts and Reagents
Legal Information
ChemDose is a trademark of Reaxa Ltd.