三(2,2,2-三氟乙氧基)硼
TL;DR: 三(2,2,2-三氟乙氧基)硼 (CAS 659-18-7) is a chemical compound with molecular formula C6H6BF9O3 and molecular weight 308.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
三(2,2,2-三氟乙氧基)硼
tris(2,2,2-trifluoroethyl) borate
Also Known As: tris(2,2,2-trifluoroethyl) borate, betaxolol, Sheppard Reagent, TTFEB, Tris(2,2,2-trifluoroethyl)Borate
| Molecular Formula | C6H6BF9O3 |
|---|---|
| Molecular Weight | 308.03 g/mol |
| LogP | 2.708 |
| Topological Polar Surface Area | 27.69 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 6 |
| Exact Mass | 308.02664 |
| Heavy Atoms | 19 |
| Complexity | 217.35725 |
Chemical Identifiers
| CAS Number | 659-18-7 |
|---|---|
| SMILES | B(OCC(F)(F)F)(OCC(F)(F)F)OCC(F)(F)F |
Product Overview
三(2,2,2-三氟乙氧基)硼 (CAS 659-18-7), with molecular formula C6H6BF9O3 and molecular weight 308.03 g/mol. IUPAC: tris(2,2,2-trifluoroethyl) borate.
Chemical Property Profile of 三(2,2,2-三氟乙氧基)硼
Property Insights of 三(2,2,2-三氟乙氧基)硼
The XLogP value of 2.708 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 三(2,2,2-三氟乙氧基)硼. With a topological polar surface area (TPSA) of 27.69 Ų, 三(2,2,2-三氟乙氧基)硼 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 三(2,2,2-三氟乙氧基)硼 has 0 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 三(2,2,2-三氟乙氧基)硼?
The CAS number of 三(2,2,2-三氟乙氧基)硼 is 659-18-7.
What is the molecular formula of 三(2,2,2-三氟乙氧基)硼?
The molecular formula of 三(2,2,2-三氟乙氧基)硼 is C6H6BF9O3.
What is the molecular weight of 三(2,2,2-三氟乙氧基)硼?
The molecular weight of 三(2,2,2-三氟乙氧基)硼 is 308.03 g/mol.
Where can I buy 三(2,2,2-三氟乙氧基)硼?
You can request a quote for 三(2,2,2-三氟乙氧基)硼 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 三(2,2,2-三氟乙氧基)硼?
Yes, KEHONG BIO provides custom synthesis services for 三(2,2,2-三氟乙氧基)硼 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.