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Bis(triphenylphosphine)palladium(II) chloride

Catalog Number ACM13965032-3
CAS 13965-03-2
Structure {[CurrentData.Name]}
IUPAC Name palladium(2+);triphenylphosphane;dichloride
Synonyms (Ph3P)2Pd(II)Cl2;Bis(triphenylphosphine)palladium Chloride;PdCl2(PPh3)2;trans-dichlorobis(triphenylphosphine)palladium (II);dichlorobis(triphenylphosphine)palladium(II)
Molecular Weight 701.91
Molecular Formula C36H30Cl2P2Pd
Canonical SMILES C1=CC=C(C=C1)P(C2=CC=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P(C2=CC=CC=C2)C3=CC=CC=C3.Cl[Pd]Cl
InChI InChI=1S/2C18H15P.2ClH.Pd/c2*1-4-10-16(11-5-1)19(17-12-6-2-7-13-17)18-14-8-3-9-15-18;/h2*1-15H;2*1H;/q;+2/p-2
InChI Key YNHIGQDRGKUECZ-UHFFFAOYSA-L
Melting Point 260ºC
Flash Point 181.7ºC
Purity 98%
Appearance Yellow crystals
Complexity 204
Covalently-Bonded Unit Count 3
EC Number 237-744-2;233-495-9
Exact Mass 700.02346
Heavy Atom Count 41
Hydrogen Bond Acceptor Count 0
Log P 8.26860
MDL Number MFCD00009593
Monoisotopic Mass 700.02346
PSA 27.18
Rotatable Bond Count 6
Stability Stable at room temperature in closed containers under normal storage and handling conditions.
Topological Polar Surface Area 0 Ų
WGK Germany 3
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