761605

BrettPhos Pd G3

98%

Manufacturer: Sigma Aldrich

CAS Number: 1470372-59-8

Synonym(S): [(2-Di-cyclohexylphosphino-3,6-dimethoxy-2′,4′,6′- triisopropyl-1,1′-biphenyl)-2-(2′-amino-1,1′ -biphenyl)]palladium(II) methanesulfonate methanesulfonate

Select a Size

Pack Size SKU Availability Price
250 MG 761605-250-MG In Stock ₹ 90.00
1 G 761605-1-G In Stock ₹ 291.00
5 G 761605-5-G In Stock ₹ 1,376.40
10 G 761605-10-G In Stock ₹ 1,998.00
IND741-1G 761605-IND741-1G In Stock ₹ 20,130.00
IND741-5G 761605-IND741-5G In Stock ₹ 55,930.00

761605 - 250 MG

₹ 90.00

In Stock

Quantity

1

Base Price: ₹ 90.00

GST (18%): ₹ 16.20

Total Price: ₹ 106.20

Quality Level

100

Assay

98%

form

solid

feature

generation 3

reaction suitability

reaction type: Buchwald-Hartwig Cross Coupling Reactionreagent type: catalystcore: palladiumreaction type: Cross Couplings

mp

150-193 °C (decomposition)

functional group

amine

SMILES string

CS(=O)(O[Pd]c1c(c2c(N)cccc2)cccc1)=O.COc3c(P(C4CCCCC4)C5CCCCC5)c(c6c(C(C)C)cc(C(C)C)cc6C(C)C)c(OC)cc3

InChI

1S/C35H53O2P.C12H10N.CH4O3S.Pd/c1-23(2)26-21-29(24(3)4)33(30(22-26)25(5)6)34-31(36-7)19-20-32(37-8)35(34)38(27-15-11-9-12-16-27)28-17-13-10-14-18-28;13-12-9-5-4-8-11(12)10-6-2-1-3-7-10;1-5(2,3)4;/h19-25,27-28H,9-18H2,1-8H3;1-6,8-9H,13H2;1H3,(H,2,3,4);/q;;;+1/p-1

InChI key

PQYBJDCHLVJYSD-UHFFFAOYSA-M

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Description

  • General description: BrettPhos 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. BrettPhos 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.
  • Application: BrettPhos Pd G3 may be used for the C-N coupling reaction between monosubstituted ureas and 1,2 dihaloaromatic system to form benzimidazolones.[1][2]It may be used in the synthesis of following compounds: [Pd(cinnamyl)(BrettPhos)]OTf by reacting with [(cinnamyl)PdCl]2 and AgOTf.[3][Pd(crotyl)(BrettPhos)]OTf by reacting with [(crotyl)PdCl]2 and AgOTf.[3][Pd(allyl)(BrettPhos)]OTf by reacting with [(allyl)PdCl]2 and AgOTf.[3]Pd(allyl)(BrettPhos)Clby reacting with [(allyl)PdCl]2.[3]For small scale and high throughput uses, product is also available as ChemBeads (928321)

SAFETY INFORMATION

Storage Class Code

11 - Combustible Solids

WGK

WGK 3

Flash Point(F)

Not applicable

Flash Point(C)

Not applicable

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Show Difference

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Sigma Aldrich

761605

98%...


Quality Level:
100

Assay:
98%

form:
solid

feature:
generation 3

reaction suitability:
reaction type: Buchwald-Hartwig Cross Coupling Reactionreagent type: catalystcore: palladiumreaction type: Cross Couplings

mp:
150-193 °C (decomposition)

functional group:
amine

SMILES string:
CS(=O)(O[Pd]c1c(c2c(N)cccc2)cccc1)=O.COc3c(P(C4CCCCC4)C5CCCCC5)c(c6c(C(C)C)cc(C(C)C)cc6C(C)C)c(OC)cc3

InChI:
1S/C35H53O2P.C12H10N.CH4O3S.Pd/c1-23(2)26-21-29(24(3)4)33(30(22-26)25(5)6)34-31(36-7)19-20-32(37-8)35(34)38(27-15-11-9-12-16-27)28-17-13-10-14-18-28;13-12-9-5-4-8-11(12)10-6-2-1-3-7-10;1-5(2,3)4;/h19-25,27-28H,9-18H2,1-8H3;1-6,8-9H,13H2;1H3,(H,2,3,4);/q;;;+1/p-1

InChI key:
PQYBJDCHLVJYSD-UHFFFAOYSA-M

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__

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__

SMILES string:
__

InChI:
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SMILES string:
CCOC(=O)c1[nH]cnc1C(F)(F)F

InChI:
1S/C7H7F3N2O2/c1-2-14-6(13)4-5(7(8,9)10)12-3-11-4/h3H,2H2,1H3,(H,11,12)

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GKUCPVKNHSQTEO-UHFFFAOYSA-N

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SMILES string:
Nc1nc2cccc(Cl)c2[nH]1

InChI:
1S/C7H6ClN3/c8-4-2-1-3-5-6(4)11-7(9)10-5/h1-3H,(H3,9,10,11)

InChI key:
WDGDTHWKGHBYNL-UHFFFAOYSA-N