BippyPhos | CAS No. 894086-00-1

BippyPhos

Basic Information

View in Editor

CAS Number

894086-00-1

Molecular Formula

C32H35N4P

Molecular Weight

506.63 g/mol

Chemical Classification

Basic Chemical Raw Materials Organic Chemicals Heterocyclic Compounds

Pharmaceutical Chemicals Pharmaceutical Intermediates Heterocyclic Intermediates

Agricultural Chemicals Pesticides Insecticides

Laboratory Chemicals Research Chemicals Biochemical Reagents

Basic Physical Properties

Melting Point

169-173 °C

Boiling Point

652.686°C at 760 mmHg

Water Solubility

Slightly soluble in water.

Flash Point

348.532°C

SMILES

View in Editor

CC(C)(C)P(C1=CC=NN1C2=C(N(N=C2C3=CC=CC=C3)C4=CC=CC=C4)C5=CC=CC=C5)C(C)(C)C

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

LogP

8.096200000000007

Topological Polar Surface Area

35.64 Å²

Hydrogen Bond Donor/Acceptor

0 / 4

Complexity

697

Safety Information

View Safety Information

Sensitiveness

Air Sensitive

Synonyms & References

English

5-(di-tert-Butylphosphino)-1',3',5'-triphenyl-1'H-1,4'-bipyrazole
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
5-(DI-TERT-BUTYLPHOSPHINO)-1', 3', 5'-TRIPHENYL-1'H-[1,4']BIPYRAZOLE
BIPPYPHOS
ditert-butyl-[2-(1,3,5-triphenylpyrazol-4-yl)pyrazol-3-yl]phosphane
5-(Di-tert-butylphosphino)-1′, 3′, 5′-triphenyl-1′H-[1,4′]bipyrazole
T-BU-BIPPYPHOS
BippyPhos
5-[Bis(1,1-dimethylethyl)phosphino]-1′,3′,5′-triphenyl-1,4′-bi-1H-pyrazole (ACI)
5-[Di(tert-butyl)phosphino]-1′,3′,5′-triphenyl-1′H-[1,4′]bipyrazolyl
tert-Butyl bippyphos
5-[BIS(TERT-BUTYL)PHOSPHINO]-1',3',5'-TRIPHENYL-1,4'-BI-1H-PYRAZOLE
DB-009555
EN300-7493978
CS-W013820
5-(DI-T-BUTYLPHOSPHINO)-1',3',5'-TRIPHENYL-1,4'-BI-1H-PYRAZOLE
AKOS016009965
5-(DI-TERT-BUTYLPHOSPHINO)-1',3',5'-TRIPHENYL-1'H-[1,4']BIPYRAZOLE
5-(Di-tert-butylphosphino)-1', 3', 5'-triphenyl-1'H-[1,4']bipyrazole
AS-72390
5-(di-tert-butylphosphino)-1', 3',5'-triphenyl-1H-[1,4]bipyrazole
PTXJGGGNGMPMBG-UHFFFAOYSA-N
894086-00-1
DTXCID90419187
DTXSID00468368
B6221
SCHEMBL140011
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
YSZC295

MDL Number

MFCD09038440

FAQ

What are the physical and chemical properties of BippyPhos (CAS: 894086-00-1)?

BippyPhos (CAS: 894086-00-1) is a crystalline compound with a molecular weight of approximately 250.2 g/mol. It has a low solubility in water but excellent solubility in organic solvents like THF and DMSO. Chemically, it is highly reactive and selective, making it ideal for cross-coupling reactions in organic synthesis.

How is BippyPhos (CAS: 894086-00-1) typically synthesized?

BippyPhos is synthesized via a multi-step process involving the protection of a biphenyl derivative, followed by the introduction of a phosphine moiety. Commonly, this involves using palladium catalysts and ligands under mild conditions to achieve high yields and selectivity in various cross-coupling reactions.

What industries use BippyPhos (CAS: 894086-00-1)?

BippyPhos is widely used in the pharmaceutical industry for the synthesis of complex molecules. It is also employed in the polymer industry for the development of functional materials, in the semiconductor industry for the production of sensors and devices, and in the sensor industry for developing high-performance detection systems.

What precautions should be taken when handling BippyPhos (CAS: 894086-00-1)?

When handling BippyPhos, it is crucial to wear appropriate personal protective equipment (PPE) such as gloves, goggles, and a lab coat. Work should be conducted in a well-ventilated fume hood to minimize inhalation risk. Spills should be immediately contained and cleaned up with caution, following safety data sheet (SDS) guidelines. Always consult the SDS for detailed safety information.