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53199-31-8

Basic Information
CAS No.: 53199-31-8
Name: Palladium,bis[tris(1,1-dimethylethyl)phosphine]-
Molecular Structure:
Molecular Structure of 53199-31-8 (Palladium,bis[tris(1,1-dimethylethyl)phosphine]-)
Formula: C24H54P2Pd
Molecular Weight: 511.06
Synonyms: Bis(tri-tert-butylphosphine)palladium;Bis[tris(tert-butyl)phosphine]palladium;bis[tris(1,1-dimethylethyl)phosphine]palladium;palladium - tri-tert-butylphosphane (1:2);Phosphine, tris(1,1-dimethylethyl)-, palladium salt (2:1);
EINECS: 640-284-9
Density:
Melting Point: >300 °C
Boiling Point: 229.4 °C at 760 mmHg
Flash Point: 94.6 °C
Solubility: insoluble in water
Appearance: Off white crystalline solid
Hazard Symbols: IrritantXi
Risk Codes: 36/37/38
Safety: 24/25
Transport Information:
PSA: 27.18000
LogP: 9.72760
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  • Bis(tri-tert-butylphosphine)palladium(0)   53199-31-8     99% in stock

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  • Palladium,bis[tris(1,1-dimethylethyl)phosphine]-

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  • Bis(tri-t-butylphosphine)palladium(0)

  • Casno:

    53199-31-8

    Bis(tri-t-butylphosphine)palladium(0)

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Specification

The Bis(tri-tert-butylphosphine)palladium(0), with the CAS registry number 53199-31-8, has the systematic name of palladium - tri-tert-butylphosphane (1:2). It is a kind of light, air and moisture sensitive, and belongs to the following product categories: Catalysts for Organic Synthesis; Classes of Metal Compounds; Homogeneous Catalysts; Metal Complexes; Pd (Palladium) Compounds; Synthetic Organic Chemistry; Transition Metal Compounds; Catalysis and Inorganic Chemistry; Homogeneous Pd Catalysts; Palladium. And the molecular formula of the chemical is C24H54P2Pd.

The characteristics of Bis(tri-tert-butylphosphine)palladium(0) are as followings: (1)ACD/LogP: 4.50; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 4.5; (4)ACD/LogD (pH 7.4): 4.5; (5)ACD/BCF (pH 5.5): 1555.62; (6)ACD/BCF (pH 7.4): 1555.62; (7)ACD/KOC (pH 5.5): 6704.43; (8)ACD/KOC (pH 7.4): 6704.43; (9)#H bond acceptors: 0; (10)#H bond donors: 0; (11)#Freely Rotating Bonds: 3; (12)Polar Surface Area: 13.59 Å2; (13)Flash Point: 94.6 °C; (14)Enthalpy of Vaporization: 44.71 kJ/mol; (15)Boiling Point: 229.4 °C at 760 mmHg; (16)Vapour Pressure: 0.105 mmHg at 25°C.

You should be cautious while dealing with this chemical. It irritates to eyes, respiratory system and skin. Therefore, you should avoid contacting with skin and eyes.

Addtionally, the following datas could be converted into the molecular structure:
(1)SMILES: [Pd].P(C(C)(C)C)(C(C)(C)C)C(C)(C)C.P(C(C)(C)C)(C(C)(C)C)C(C)(C)C
(2InChI: InChI=1/2C12H27P.Pd/c2*1-10(2,3)13(11(4,5)6)12(7,8)9;/h2*1-9H3
(3)InChIKey: MXQOYLRVSVOCQT-UHFFFAOYAH