[2′-(Amino-κN)[1,1′-biphenyl]-2-yl-κC][[5-(diphenylphosphino)-9,9-dimethyl-9H-xanthen-4-yl]diphenylphosphine-κP](methanesulfonato-κO)palladium

CAS Registry Number®

1445085-97-1

CAS Name

[2′-(Amino-κN)[1,1′-biphenyl]-2-yl-κC][[5-(diphenylphosphino)-9,9-dimethyl-9H-xanthen-4-yl]diphenylphosphine-κP](methanesulfonato-κO)palladium

Molecular Formula

C52H45NO4P2PdS

Cite this Page

[2′-(Amino-κN)[1,1′-biphenyl]-2-yl-κC][[5-(diphenylphosphino)-9,9-dimethyl-9H-xanthen-4-yl]diphenylphosphine-κP](methanesulfonato-κO)palladium.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=1445085-97-1 (retrieved 2024-11-25) (CAS RN: 1445085-97-1).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C39H32OP2.C12H10N.CH4O3S.Pd/c1-39(2)33-25-15-27-35(41(29-17-7-3-8-18-29)30-19-9-4-10-20-30)37(33)40-38-34(39)26-16-28-36(38)42(31-21-11-5-12-22-31)32-23-13-6-14-24-32;13-12-9-5-4-8-11(12)10-6-2-1-3-7-10;1-5(2,3)4;/h3-28H,1-2H3;1-6,8-9H,13H2;1H3,(H,2,3,4);/q;-1;;+2/p-1

InChIKey

InChIKey=OIQIZOZMASPGRN-UHFFFAOYSA-M

SMILES

[P]([Pd+2]1([O-]S(C)(=O)=O)[C-]=2C(C=3C([NH2]1)=CC=CC3)=CC=CC2)(C4=C5C(C(C)(C)C=6C(O5)=C(P(C7=CC=CC=C7)C8=CC=CC=C8)C=CC6)=CC=C4)(C9=CC=CC=C9)C%10=CC=CC=C%10

Canonical SMILES

O=S(=O)([O-][Pd+2]1([C-]=2C=CC=CC2C=3C=CC=CC3[NH2]1)[P](C=4C=CC=CC4)(C=5C=CC=CC5)C=6C=CC=C7C6OC=8C(=CC=CC8C7(C)C)P(C=9C=CC=CC9)C=%10C=CC=CC%10)C

Other Names for this Substance

  • Palladium, [2′-(amino-κN)[1,1′-biphenyl]-2-yl-κC][[5-(diphenylphosphino)-9,9-dimethyl-9H-xanthen-4-yl]diphenylphosphine-κP](methanesulfonato-κO)-
  • [2′-(Amino-κN)[1,1′-biphenyl]-2-yl-κC][[5-(diphenylphosphino)-9,9-dimethyl-9H-xanthen-4-yl]diphenylphosphine-κP](methanesulfonato-κO)palladium
  • Xantphos Pd G3

CAS INSIGHTSTM
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