ChemicalBook--->CAS DataBase List--->894086-00-1

894086-00-1

894086-00-1 Structure

894086-00-1 Structure
IdentificationBack Directory
[Name]

5-(DI-TERT-BUTYLPHOSPHINO)-1', 3', 5'-TRIPHENYL-1'H-[1,4']BIPYRAZOLE
[CAS]

894086-00-1
[Synonyms]

BIPPYPHOS
t-Bu-BippyPhos
95% t-Bu-BippyPhos
5-(Di-t-butylphosphino)-1',3',5'-triphenyl-1,4'-bi-1H-pyrazole
5-(di-tert-butylphosphanyl)-1',3',5'-triphenyl-1'H-1,4'-bipyrazole
ditert-butyl-[2-(1,3,5-triphenylpyrazol-4-yl)pyrazol-3-yl]phosphane
5-[BIS(TERT-BUTYL)PHOSPHINO]-1',3',5'-TRIPHENYL-1,4'-BI-1H-PYRAZOLE
5-(DI-TERT-BUTYLPHOSPHINO)-1', 3', 5'-TRIPHENYL-1'H-[1,4']BIPYRAZOLE
5-[Di(tert-butyl)phosphino]-1',3',5'-triphenyl-1'H-[1,4']bipyrazolyl
5-(Di-tert-butylphosphino)-1', 3', 5'-triphenyl-1'H-[1,4']bipyrazole 97%
5-(Di-t-butylphosphino)-1',3',5'-triphenyl-1,4'-bi-1H-pyrazole, min. 95%
5-[bis(1,1- dimethylethyl)phosphino]-1',3',5'-triphenyl-1,4'-Bi-1H-pyrazole
1,4'-Bi-1H-pyrazole, 5-[bis(1,1-dimethylethyl)phosphino]-1',3',5'-triphenyl-
5-(Di-t-butylphosphino)-1',3',5'-triphenyl-1,4'-bi-1H-pyrazole,97% t-Bu-BippyPhos
5-(Di-t-butylphosphino)-1-(1,3,5-triphenyl-1H-pyrazol-4-yl)-1H-pyrazole, (BippyPhos)
5-(Di-t-butylphosphino)-1',3',5'-triphenyl-1,4'-bi-1H-pyrazole, min. 97% t-Bu-BippyPhos
5-(Di-t-butylphosphino)-1-(1,3,5-triphenyl-1H-pyrazol-4-yl)-1H-pyrazole, 98% (BippyPhos)
5-(Di-t-butylphosphino)-1',3',5'-triphenyl-1,4'-bi-1H-pyrazole, min. 95% t-Bu-BippyPhos
[Molecular Formula]

C32H35N4P
[MDL Number]

MFCD09038440
[MOL File]

894086-00-1.mol
[Molecular Weight]

506.621
Chemical PropertiesBack Directory
[Melting point ]

169-173 °C
[Boiling point ]

652.7±55.0 °C(Predicted)
[storage temp. ]

Inert atmosphere,Room Temperature
[form ]

Solid
[pka]

-0.35±0.19(Predicted)
[color ]

White to tan
[Water Solubility ]

Slightly soluble in water.
[Sensitive ]

Air Sensitive
[InChI]

InChI=1S/C32H35N4P/c1-31(2,3)37(32(4,5)6)27-22-23-33-36(27)30-28(24-16-10-7-11-17-24)34-35(26-20-14-9-15-21-26)29(30)25-18-12-8-13-19-25/h7-23H,1-6H3
[InChIKey]

PTXJGGGNGMPMBG-UHFFFAOYSA-N
[SMILES]

N1(C2=C(C3=CC=CC=C3)N(C3=CC=CC=C3)N=C2C2=CC=CC=C2)C(P(C(C)(C)C)C(C)(C)C)=CC=N1
Safety DataBack Directory
[Symbol(GHS) ]

Exclamation Mark (GHS07)
GHS07
[Signal word ]

Warning
[Hazard statements ]

H315-H319-H335
[Precautionary statements ]

P261-P280-P305+P351+P338-P304+P340-P405-P501A
[Risk Statements ]

36/37/38
[Safety Statements ]

26-37
[WGK Germany ]

3
[TSCA ]

No
[HS Code ]

2933199090
[Storage Class]

11 - Combustible Solids
Hazard InformationBack Directory
[Uses]

5-(Di-tert-butylphosphino)-1', 3', 5'-triphenyl-1'H-[1,4']bipyrazole is a non-proprietary ligand for palladium-catalyzed amination of aryl halides including aryl chlorides. Works best when the palladium source is Pd2(dba)3
[reaction suitability]

reaction type: Cross Couplings
reagent type: ligand
reaction type: Amidations
reagent type: ligand
reaction type: Buchwald-Hartwig Cross Coupling Reaction
reagent type: ligand
reaction type: Coupling Reactions
Spectrum DetailBack Directory
[Spectrum Detail]

5-(DI-TERT-BUTYLPHOSPHINO)-1', 3', 5'-TRIPHENYL-1'H-[1,4']BIPYRAZOLE(894086-00-1)1HNMR
5-(DI-TERT-BUTYLPHOSPHINO)-1', 3', 5'-TRIPHENYL-1'H-[1,4']BIPYRAZOLE(894086-00-1)31PNMR
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