[2-(dimethylamino)ethyl]dimethylamine; dichloropalladium

• ChemBase ID: 148522
• Molecular Formular: C6H16Cl2N2Pd
• Molecular Mass: 293.53064
• Monoisotopic Mass: 291.97253988
• SMILES: CN(C)CCN(C)C.Cl[Pd]Cl
• Canonical SMILES: CN(CCN(C)C)C.Cl[Pd]Cl
• InChI: InChI=1S/C6H16N2.2ClH.Pd/c1-7(2)5-6-8(3)4;;;/h5-6H2,1-4H3;2*1H;/q;;;+2/p-2
• InChIKey: FJOUSQLMIDWVAY-UHFFFAOYSA-L

NAMES AND DATABASE IDS

Names

• IUPAC name: [2-(dimethylamino)ethyl]dimethylamine; dichloropalladium
• IUPAC Traditional name: palladium chloride; temed
• Synonyms: NSC 241246; Tetramethylethylenediaminepalladium dichloride; [1,2-Bis(dimethylamino)ethane]dichloropalladium; Dichloro(N,N,N′,N′-tetramethylethylenediamine)palladium(II); 二氯(N,N,N′,N′-四甲基乙二胺)钯

Database IDs

• CAS Number: 14267-08-4
• MDL Number: MFCD00075317
• PubChem SID: 162242697; 24861301
• PubChem CID: 6102152

CALCULATED PROPERTIES

• H Acceptors: 2
• H Donor: 0
• LogD (pH = 5.5): -3.377547
• LogD (pH = 7.4): -1.7988784
• Log P: 0.208814
• Molar Refractivity: 38.0072 cm^3
• Polarizability: 14.858968 Å^3
• Polar Surface Area: 6.48 Å^2
• Rotatable Bonds: 3
• Lipinski's Rule of Five: true

PROPERTIES

Physical Property

• Melting Point: 245 °C (dec.)(lit.)

Safety Information

• European Hazard Symbols: Irritant (Xi)
• German water hazard class: 3
• Risk Statements: 36/37/38
• Safety Statements: 26-37/39
• GHS Pictograms: GHS07
• GHS Signal Word: Warning
• GHS Hazard statements: H315-H319-H335
• GHS Precautionary statements: P261-P305 + P351 + P338
• Personal Protective Equipment: dust mask type N95 (US), Eyeshields, Gloves

Product Information

• Purity: 99%
• Linear Formula: [(CH3)2NCH2CH2N(CH3)2]PdCl2

DETAILS

Sigma Aldrich - 345229

Packaging
1 g in glass bottle
Application
Catalyst for:
• Cross-coupling reactions1
• Catalytic reduction reactions2
• Preparation of silyl ethers via reaction of silicon-hydrogen bond with alcohols3
• Oxidative carbonylation reactions4