tBuXPhos
TL;DR: tBuXPhos (CAS 564483-19-8) is a chemical compound with molecular formula C29H45P and molecular weight 424.64 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-Di-tert-butylphosphino-2',4',6'-triisopropylbiphenyl
Also Known As: tert-Butyl XPhos; t-Bu XPhos; tBuXPhos ligand
Technical Specifications
| Molecular Formula | C29H45P |
| Molecular Weight | 424.64 g/mol |
| XLogP | 8.5 |
| Topological Polar Surface Area (TPSA) | 0.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 0 |
| Rotatable Bonds | 7 |
| Exact Mass | 424.3259 Da |
| Heavy Atoms | 30 |
| Complexity | 485.0 |
| Appearance | Solid |
| Purity | >=98% |
| Melting Point | 148-151 C |
| SMILES | CC(C)(C)P(C1=CC=CC=C1C2=C(C=C(C=C2C(C)C)C(C)C)C(C)C)C(C)(C)C |
Product Description
Applications: Palladium-catalyzed C-O and C-N cross-coupling; gold-catalyzed cycloaddition
Chemical Property Profile of tBuXPhos
Property Insights of tBuXPhos
The XLogP value of 8.5 indicates that tBuXPhos is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 0.0 Ų, tBuXPhos exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, tBuXPhos has 0 hydrogen bond donor(s) and 0 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
What is the CAS number of tBuXPhos?
The CAS number of tBuXPhos is 564483-19-8.
What is the molecular formula of tBuXPhos?
The molecular formula of tBuXPhos is C29H45P.
What is the molecular weight of tBuXPhos?
The molecular weight of tBuXPhos is 424.64 g/mol.
What does tBuXPhos look like?
tBuXPhos appears as Solid.
What are the applications of tBuXPhos?
Palladium-catalyzed C-O and C-N cross-coupling; gold-catalyzed cycloaddition
Where can I buy tBuXPhos?
You can request a quote for tBuXPhos directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for tBuXPhos?
Yes, CoreyChem provides custom synthesis services for tBuXPhos and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.
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tBuXPhos — The Specialist Ligand for C–O Coupling and a Greener Alternative for Industrial Cross-Coupling
tBuXPhos — The Specialist Ligand for C–O Coupling and a Greener Alternative for Industrial Cross-Coupling