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2129-31-9

2129-31-9 Structure

2129-31-9 Structure
IdentificationBack Directory
[Name]

4-(DIPHENYLPHOSPHINO)BENZOIC ACID
[CAS]

2129-31-9
[Synonyms]

4-(DIPHENYLPHOSPHINO)BENZOIC ACID
p-(Diphenylphosphino)benzoic acid
4-Diphenylphosphanyl-benzoesaeure
4-di(phenyl)phosphanylbenzoic acid
(4-Carboxyphenyl)diphenylphosphine
Diphenyl(p-carboxyphenyl) phosphine
Benzoic acid, 4-(diphenylphosphino)-
4-(Diphenylphosphino)benzoic Acid >
4-(Diphenylphosphino)benzoic acid 97%
[Molecular Formula]

C19H15O2P
[MDL Number]

MFCD00407264
[MOL File]

2129-31-9.mol
[Molecular Weight]

306.29
Chemical PropertiesBack Directory
[Melting point ]

157-160 °C(lit.)
[Boiling point ]

448.0±28.0 °C(Predicted)
[storage temp. ]

Inert atmosphere,Room Temperature
[form ]

Crystalline Powder
[pka]

4.01±0.10(Predicted)
[color ]

White to yellow
[InChI]

1S/C19H15O2P/c20-19(21)15-11-13-18(14-12-15)22(16-7-3-1-4-8-16)17-9-5-2-6-10-17/h1-14H,(H,20,21)
[InChIKey]

GXMHDTPYKRTARV-UHFFFAOYSA-N
[SMILES]

OC(=O)c1ccc(cc1)P(c2ccccc2)c3ccccc3
[CAS DataBase Reference]

2129-31-9
Safety DataBack Directory
[Hazard Codes ]

Xi
[Risk Statements ]

36/37/38
[Safety Statements ]

26-37/39
[WGK Germany ]

3
[HS Code ]

29163990
[Storage Class]

11 - Combustible Solids
[Hazard Classifications]

Eye Irrit. 2
Skin Irrit. 2
STOT SE 3
Hazard InformationBack Directory
[Uses]

4-(Diphenylphosphino)benzoic acid can be used as a ligand in the synthesis of:
  • Organostannoxane-supported palladium nanoparticles. The resulting catalysts show high activity and selectivity in Suzuki-coupling reactions.
  • Polymetallic ruthenium-zinc complex catalyst for the hydrogenation of levulinic acid to γ-valerolactone.
[reaction suitability]

reaction type: Buchwald-Hartwig Cross Coupling Reaction
reaction type: Heck Reaction
reaction type: Hiyama Coupling
reaction type: Negishi Coupling
reaction type: Sonogashira Coupling
reaction type: Stille Coupling
reaction type: Suzuki-Miyaura Coupling
reagent type: ligand
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