[Di-tert-butyl(chloro)phosphine]palladium(II) Dichloride Dimer - ≥97% , CAS No.386706-33-8

CAS: 386706-33-8 Cat. No.: D154284 Molecular Weight: 715.95 EC Number: 679-772-1 PubChem CID: 53384540

GRADE & PURITY ≥97%

Synonyms

Palladium,bis[bis(1,1-dimethylethyl)phosphinous chloride-kP]di-m-chlorodichlorodi- (9CI) | Dichloro[di-tert-butyl(chloro)phosphine]palladium(II) Dimer | DICHLORO(CHLORODI-T-BUTYLPHOSPHINE)PALLADIUM(II) DIMER | F10010 | D3704 | [Di-tert-butyl(chloro)phosph

Storage

Store at 2-8°C,Argon charged

Shipped In

Wet ice

Specifications

Synonyms

Palladium, bis[bis(1, 1-dimethylethyl)phosphinous chloride-kP]di-m-chlorodichlorodi- (9CI) | Dichloro[di-tert-butyl(chloro)phosphine]palladium(II) Dimer | DICHLORO(CHLORODI-T-BUTYLPHOSPHINE)PALLADIUM(II) DIMER | F10010 | D3704 | [Di-tert-butyl(chloro)phosph

Specifications & Purity

≥97%

Storage

Store at 2-8°C, Argon charged

Shipped In

Wet ice

This product requires cold chain shipping. Ground and other economy services are not available.

Purity

≥97%

Names and Identifiers

• Canonical Smiles: CC(C)(C)P(C(C)(C)C)Cl.CC(C)(C)P(C(C)(C)C)Cl.[Cl-].[Cl-].[Cl-].[Cl-].[Pd+2].[Pd+2]
• IUPAC Name: ditert-butyl(chloro)phosphane;palladium(2+);tetrachloride
• InChIKey: NJIMMSLZDJFGSV-UHFFFAOYSA-J
• INCHI: 1S/2C8H18ClP.4ClH.2Pd/c2*1-7(2,3)10(9)8(4,5)6;;;;;;/h2*1-6H3;4*1H;;/q;;;;;;2*+2/p-4
• Isomeric SMILES: CC(C)(C)P(C(C)(C)C)Cl.CC(C)(C)P(C(C)(C)C)Cl.[Cl-].[Cl-].[Cl-].[Cl-].[Pd+2].[Pd+2]
• PubChem CID: 53384540
• Molecular Weight: 715.95

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Organophosphorus compounds
    • Class Alkylhalophosphines

• Kingdom: Organic compounds
• Superclass: Organophosphorus compounds
• Class: Alkylhalophosphines
• Subclass: Not available
• Intermediate Tree Nodes: Not available
• Direct Parent: Alkylhalophosphines
• Alternative Parents: Organic transition metal salts Hydrocarbon derivatives
• Molecular Framework: Not available
• Substituents: Alkylhalophosphine - Organic metal salt - Organic transition metal salt - Hydrocarbon derivative - Aliphatic acyclic compound
• Description: This compound belongs to the class of organic compounds known as alkylhalophosphines. These are organophosphorus compounds with the general formula RPX2 or R2PX (R=alkyl, X=halogen).
• External Descriptors: Not available

Data sources

1. Djoumbou Feunang Y, Eisner R, Knox C, Chepelev L, Hastings J, Owen G, Fahy E, Steinbeck C, Subramanian S, Bolton E, Greiner R, and Wishart DS. ClassyFire: Automated Chemical Classification With A Comprehensive, Computable Taxonomy. Journal of Cheminformatics, 2016, 8:61.

DOI: 10.1186/s13321-016-0174-y

Chemical and Physical Properties

• Melt Point(°C): 222 °C(dec.)
• Molecular Weight: 716.000 g/mol
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 4
• Exact Mass: 715.847 Da
• Monoisotopic Mass: 711.849 Da
• Topological Polar Surface Area: 0.000 Ų
• Heavy Atom Count: 26
• Formal Charge: 0
• Complexity: 93.400
• Isotope Atom Count: 0
• Defined Atom Stereocenter Count: 0
• Undefined Atom Stereocenter Count: 0
• Defined Bond Stereocenter Count: 0
• Undefined Bond Stereocenter Count: 0
• The total count of all stereochemical bonds: 0
• Covalently-Bonded Unit Count: 8

XLogP3