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[(1,3,5,7-Tetramethyl-6-phenyl-2,4,6-trioxa-6-phosphaadamantane)-2-(2'-amino-1,1'-biphenyl)]palladium(II) methanesulfonate

[(1,3,5,7-Tetramethyl-6-phenyl-2,4,6-trioxa-6-phosphaadamantane)-2-(2'-amino-1,1'-biphenyl)]palladium(II) methanesulfonate

Inquiry

Molecular Formula:

C29H34NO6PPdS

Molecular Weight:

662.04

CAS Number:

2230788-58-4

Catalog Number:

2230788-58-4

Product Information

Molecular Formula:

C29H34NO6PPdS

Molecular Weight:

662.04

Description

(1,3,5,7-Tetramethyl-6-phenyl-2,4,6-trioxa-6-phosphaadamantane)-2-(2'-amino-1,1'-biphenyl)]palladium(II) methanesulfonate, an intricately structured chemical compound, is a biochemical agent known for catalysis within biomedical laboratories. Its key functions extend to facilitating unique drug synthesis sequences, thereby providing potential opportunities for therapeutic research in diseases such as malignancies.

Synonyms

meCgPPh Pd G3

IUPAC Name

methanesulfonatepalladium(2+)2-phenylaniline(1R,3S)-1,3,5,7-tetramethyl-2-phenyl-4,6,9-trioxa-2-phosphatricyclo[3.3.1.13,7]decane

Canonical SMILES

CC12CC3(OC(O1)(OC(C2)(P3C4=CC=CC=C4)C)C)C.CS(=O)(=O)[O-].C1=CC=C([C-]=C1)C2=CC=CC=C2N.[Pd+2]

InChI

InChI=1S/C16H21O3P.C12H10N.CH4O3S.Pd/c1-13-10-14(2)18-16(4,17-13)19-15(3,11-13)20(14)12-8-6-5-7-9-1213-12-9-5-4-8-11(12)10-6-2-1-3-7-101-5(2,3)4/h5-9H,10-11H2,1-4H31-6,8-9H,13H21H3,(H,2,3,4)/q-1+2/p-1/t13?,14-,15+,16?,20?

InChI Key

BIJGQELPKLBCGJ-OAILJLFKSA-M

Melting Point

130-136 °C (decomposition)

Flash Point

Not applicable

Storage

2-8°C

Computed Properties

Hydrogen Bond Donor Count

Hydrogen Bond Acceptor Count

Rotatable Bond Count

Exact Mass

661.08793 g/mol

Monoisotopic Mass

661.08793 g/mol

Topological Polar Surface Area

119Å²

Heavy Atom Count

Formal Charge

Complexity

756

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)

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The dilution calculator equation

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

This equation is commonly abbreviated as: C₁V₁ = C₂V₂

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[(1,3,5,7-Tetramethyl-6-phenyl-2,4,6-trioxa-6-phosphaadamantane)-2-(2'-amino-1,1'-biphenyl)]palladium(II) methanesulfonate

Product Information

Computed Properties

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