二丁基三氟甲磺酸硼
TL;DR: 二丁基三氟甲磺酸硼 (CAS 60669-69-4) is a chemical compound with molecular formula C9H18BF3O3S and molecular weight 274.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
二丁基三氟甲磺酸硼
dibutylboranyl trifluoromethanesulfonate
Also Known As: dibutylboranyl trifluoromethanesulfonate, Dibutylboron trifluoromethanesulfonate, Dibutylboron triflate, nBu2BOTf, Bu2BOTf
| Molecular Formula | C9H18BF3O3S |
|---|---|
| Molecular Weight | 274.10 g/mol |
| LogP | 3.4443 |
| Topological Polar Surface Area | 43.37 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 8 |
| Exact Mass | 274.10217 |
| Heavy Atoms | 17 |
| Complexity | 295.09818 |
Chemical Identifiers
| CAS Number | 60669-69-4 |
|---|---|
| SMILES | B(CCCC)(CCCC)OS(=O)(=O)C(F)(F)F |
Product Overview
二丁基三氟甲磺酸硼 (CAS 60669-69-4), with molecular formula C9H18BF3O3S and molecular weight 274.10 g/mol. IUPAC: dibutylboranyl trifluoromethanesulfonate.
Chemical Property Profile of 二丁基三氟甲磺酸硼
Property Insights of 二丁基三氟甲磺酸硼
The XLogP value of 3.4443 indicates that 二丁基三氟甲磺酸硼 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 43.37 Ų, 二丁基三氟甲磺酸硼 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 二丁基三氟甲磺酸硼 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 二丁基三氟甲磺酸硼?
The CAS number of 二丁基三氟甲磺酸硼 is 60669-69-4.
What is the molecular formula of 二丁基三氟甲磺酸硼?
The molecular formula of 二丁基三氟甲磺酸硼 is C9H18BF3O3S.
What is the molecular weight of 二丁基三氟甲磺酸硼?
The molecular weight of 二丁基三氟甲磺酸硼 is 274.10 g/mol.
Where can I buy 二丁基三氟甲磺酸硼?
You can request a quote for 二丁基三氟甲磺酸硼 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 二丁基三氟甲磺酸硼?
Yes, KEHONG BIO provides custom synthesis services for 二丁基三氟甲磺酸硼 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.