APhos Pd G4

Inquiry

Molecular Formula:

C30H43N2O3PPdS

Molecular Weight:

649.13

Product Information

Molecular Formula:

C30H43N2O3PPdS

Molecular Weight:

649.13

Description

APhos Pd G4 is a powerful ligand for classic cross-coupling reactions combined with the Buchwald Fourth Generation Palladacycle. Bench stable, soluble in most organic solvents.

Synonyms

APhos Pd G4; APhos Pd G4, 95%; AT33863;

IUPAC Name

4-ditert-butylphosphanyl-N,N-dimethylanilinemethanesulfonic acidN-methyl-2-phenylanilinepalladium

Canonical SMILES

CC(C)(C)P(C1=CC=C(C=C1)N(C)C)C(C)(C)C.CNC1=CC=CC=C1C2=CC=CC=[C-]2.CS(=O)(=O)O.[Pd]

InChI

InChI=1S/C16H28NP.C13H12N.CH4O3S.Pd/c1-15(2,3)18(16(4,5)6)14-11-9-13(10-12-14)17(7)81-14-13-10-6-5-9-12(13)11-7-3-2-4-8-111-5(2,3)4/h9-12H,1-8H32-7,9-10,14H,1H31H3,(H,2,3,4)/q-1

InChI Key

VCZFJDZNHVMFMR-UHFFFAOYSA-N

Melting Point

204 °C

Flash Point

Not applicable

Purity

95%

Computed Properties

Hydrogen Bond Donor Count

Hydrogen Bond Acceptor Count

Rotatable Bond Count

Exact Mass

649.18451 g/mol

Monoisotopic Mass

649.18451 g/mol

Topological Polar Surface Area

78Å²

Heavy Atom Count

Formal Charge

-1

Complexity

701

Isotope Atom Count

Defined Atom Stereocenter Count

Undefined Atom Stereocenter Count

Defined Bond Stereocenter Count

Undefined Bond Stereocenter Count

Covalently-Bonded Unit Count

Compound Is Canonicalized

Yes

The molarity calculator equation

Mass (g) = Concentration (mol/L) × Volume (L) × Molecular Weight (g/mol)

Mass

Concentration

Volume

Molecular Weight *

Calculate

The dilution calculator equation

Concentration _(start) × Volume _(start) = Concentration _(final) × Volume _(final)

This equation is commonly abbreviated as: C₁V₁ = C₂V₂

Concentration _(start)

Volume _(start)

Concentration _(final)

Volume _(final)

Calculate

APhos Pd G4

Product Information

Computed Properties

Related Products