931055

tBuXPhos Pd G3 ChemBeads

Manufacturer: Sigma Aldrich

CAS Number: 1447963-75-8

Synonym(S): [(2-Di-tert-butylphosphino-2′,4′,6′-triisopropyl-1,1′-biphenyl)-2-(2′-amino-1,1′-biphenyl)] palladium(II) methanesulfonate, tBuXPhos-Pd-G3

Select a Size

Pack Size SKU Availability Price
1 G 931055-1-G In Stock ₹ 29,559.30

931055 - 1 G

₹ 29,559.30

In Stock

Quantity

1

Base Price: ₹ 29,559.30

GST (18%): ₹ 5,320.674

Total Price: ₹ 34,879.974

Assay

~6 wt.% loading of catalyst

Quality Level

100

form

solid

reaction suitability

reagent type: catalystreaction type: Cross Couplings

extent of labeling

~6 wt. % loading of catalyst

SMILES string

O=S([O-][Pd+2]1(P(C(C)(C)C)(C(C)(C)C)C2=CC=CC=C2C3=C(C(C)C)C=C(C(C)C)C=C3C(C)C)[C-]4=C(C5=C(N1)C=CC=C5)C=CC=C4)(C)=O

InChI

1S/C29H45P.C12H10N.CH4O3S.Pd/c1-19(2)22-17-24(20(3)4)27(25(18-22)21(5)6)23-15-13-14-16-26(23)30(28(7,8)9)29(10,11)12;13-12-9-5-4-8-11(12)10-6-2-1-3-7-10;1-5(2,3)4;/h13-21H,1-12H3;1-6,8-9H,13H2;1H3,(H,2,3,4);/q;;;+1/p-1

InChI key

SQQOHCLJPLSJGX-UHFFFAOYSA-M

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Description

  • General description: tBuXPhos Pd G3 is a third generation (G3) Buchwald precatalyst. It is air, moisture and thermally-stable and is highly soluble in a wide range of common organic solvents. It has long life in solutions. tBuXPhos Pd G3 is an excellent reagent for Buchwald-Hartwig cross-coupling reaction. Some of its unique features include lower catalyst loadings, shorter reaction time, efficient formation of the active catalytic species and accurate control of ligand: palladium ratio.For larger scale uses, product also available in powdered form (762229)
  • Application: tBuXPhos Pd G3 may be used to synthesize 4-cyano-7-azaindole from 4-chloro-7-azaindole by cyanation reaction. It may also be used for the α-arylation reaction of acetate esters at room temperature.ChemBeads are chemical coated glass beads. ChemBeads offer improved flowability and chemical uniformity perfect for automated solid dispensing and high-throughput experimentation. The method of creating ChemBeads uses no other chemicals or surfactants allowing the user to accurately dispense sub-milligram amounts of chemical.Learn more about ChemBeads products
  • Other Notes: High-Throughput Reaction Screening with Nanomoles of Solid Reagents Coated on Glass BeadsVersatile Methods to Dispense Sub-Milligram Quantities of Solids using Chemical Coated Beads for High-Throughput ExperimentationChemBead Enabled High-Throughput Cross-Electrophile Coupling Reveals a New Complementary Ligand

SAFETY INFORMATION

WGK

WGK 3

Flash Point(F)

Not applicable

Flash Point(C)

Not applicable

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931055

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Assay:
~6 wt.% loading of catalyst

Quality Level:
100

form:
solid

reaction suitability:
reagent type: catalystreaction type: Cross Couplings

extent of labeling:
~6 wt. % loading of catalyst

SMILES string:
O=S([O-][Pd+2]1(P(C(C)(C)C)(C(C)(C)C)C2=CC=CC=C2C3=C(C(C)C)C=C(C(C)C)C=C3C(C)C)[C-]4=C(C5=C(N1)C=CC=C5)C=CC=C4)(C)=O

InChI:
1S/C29H45P.C12H10N.CH4O3S.Pd/c1-19(2)22-17-24(20(3)4)27(25(18-22)21(5)6)23-15-13-14-16-26(23)30(28(7,8)9)29(10,11)12;13-12-9-5-4-8-11(12)10-6-2-1-3-7-10;1-5(2,3)4;/h13-21H,1-12H3;1-6,8-9H,13H2;1H3,(H,2,3,4);/q;;;+1/p-1

InChI key:
SQQOHCLJPLSJGX-UHFFFAOYSA-M

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~5 wt.% loading of catalyst

Quality Level:
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solid

reaction suitability:
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extent of labeling:
~5 wt. % loading of catalyst

SMILES string:
__

InChI:
1S/C27H38N2.C5H4ClN.2ClH.Pd/c1-18(2)22-11-9-12-23(19(3)4)26(22)28-15-16-29(17-28)27-24(20(5)6)13-10-14-25(27)21(7)8;6-5-2-1-3-7-4-5;;;/h9-16,18-21H,17H2,1-8H3;1-4H;2*1H;/q;;;;+2/p-2

InChI key:
BLDKGTGQENJFON-UHFFFAOYSA-L

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NCCCOCCOCCOCCCNC(OC(C)(C)C)=O

InChI:
1S/C15H32N2O5/c1-15(2,3)22-14(18)17-7-5-9-20-11-13-21-12-10-19-8-4-6-16/h4-13,16H2,1-3H3,(H,17,18)

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WHHYAYNALHPDGJ-UHFFFAOYSA-N

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__

InChI key:
__