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Details

Stereochemistry ACHIRAL
Molecular Formula C39H32OP2.C13H12N.CH3O3S.Pd
Molecular Weight 962.38
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0
Stereo Comments SP-4-3

SHOW SMILES / InChI
Structure of XantPhos Pd G4

SMILES

[Pd++].CS([O-])(=O)=O.CNC1=CC=CC=C1C2=CC=CC=[C-]2.CC3(C)C4=CC=CC(P(C5=CC=CC=C5)C6=CC=CC=C6)=C4OC7=C(C=CC=C37)P(C8=CC=CC=C8)C9=CC=CC=C9

InChI

InChIKey=FVAYNLBOLDFXIV-UHFFFAOYSA-M
InChI=1S/C39H32OP2.C13H12N.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;1-14-13-10-6-5-9-12(13)11-7-3-2-4-8-11;1-5(2,3)4;/h3-28H,1-2H3;2-7,9-10,14H,1H3;1H3,(H,2,3,4);/q;-1;;+2/p-1

HIDE SMILES / InChI

Approval Year

Name Type Language
XantPhos Pd G4
Brand Name English
Palladium, [[5-(diphenylphosphino)-9,9-dimethyl-9H-xanthen-4-yl]diphenylphosphine-κP](methanesulfonato-κO)[2′-(methylamino-κN)[1,1′-biphenyl]-2-yl-κC]-, (SP-4-3)-
Common Name English
(SP-4-3)-[[5-(diphenylphosphino)-9,9-dimethyl-9H-xanthen-4-yl]diphenylphosphine-κP](methanesulfonato-κO)[2′-(methylamino-κN)[1,1′-biphenyl]-2-yl-κC]- Palladium
Common Name English
Xantphos Pd-G 4
Common Name English
Xantphos Palladacycle Gen 4
Common Name English
Code System Code Type Description
FDA UNII
CE2A2MX9WS
Created by admin on Sat Dec 16 19:53:23 GMT 2023 , Edited by admin on Sat Dec 16 19:53:23 GMT 2023
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PUBCHEM
121237590
Created by admin on Sat Dec 16 19:53:23 GMT 2023 , Edited by admin on Sat Dec 16 19:53:23 GMT 2023
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CAS
1621274-19-8
Created by admin on Sat Dec 16 19:53:23 GMT 2023 , Edited by admin on Sat Dec 16 19:53:23 GMT 2023
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