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 Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-Di-tert-butylphosphino-2',4',6'-triisopropylbiphenyl
Also Known As: tert-Butyl XPhos; t-Bu XPhos; tBuXPhos ligand
| Molecular Formula | C29H45P |
|---|---|
| Molecular Weight | 424.64 g/mol |
| LogP | 8.5 |
| Topological Polar Surface Area | 0.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 0 |
| Rotatable Bonds | 7 |
| Exact Mass | 424.3259 |
| Heavy Atoms | 30 |
| Complexity | 485.0 |
| Appearance | Solid |
| Melting Point | 148-151 C |
Chemical Identifiers
| CAS Number | 564483-19-8 |
|---|---|
| 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 |
📋 Applications
Palladium-catalyzed C-O and C-N cross-coupling; gold-catalyzed cycloaddition
Product Overview
tBuXPhos (CAS 564483-19-8), with molecular formula C29H45P and molecular weight 424.64 g/mol. IUPAC: 2-Di-tert-butylphosphino-2',4',6'-triisopropylbiphenyl.
Appearance: Solid, purity >=98%.
Primary 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
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 KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for tBuXPhos?
Yes, KEHONG BIO provides custom synthesis services for tBuXPhos and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.