Trifluoroboroxine
TL;DR: Trifluoroboroxine (CAS 13703-95-2) is a chemical compound with molecular formula B3F3O3 and molecular weight 138.01 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2,4,6-trifluoro-1,3,5,2,4,6-trioxatriborinane
Also Known As: Trifluoroboroxine, Trifluoroboroxin, Boroxin, trifluoro-, 2,4,6-trifluoro-1,3,5,2,4,6-trioxatriborinane, Boroxin,trifluoro-(6CI,7CI,8CI,9CI)
| Molecular Formula | B3F3O3 |
|---|---|
| Molecular Weight | 138.01 g/mol |
| LogP | -0.087 |
| Topological Polar Surface Area | 27.7 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 0 |
| Exact Mass | 138.00787 |
| Heavy Atoms | 9 |
| Complexity | 69.0 |
Chemical Identifiers
| CAS Number | 13703-95-2 |
|---|---|
| SMILES | B1(OB(OB(O1)F)F)F |
| InChIKey | FVWCXYPJHTZDEU-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 3 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Trifluoroboroxine (CAS 13703-95-2), with molecular formula B3F3O3 and molecular weight 138.01 g/mol. IUPAC: 2,4,6-trifluoro-1,3,5,2,4,6-trioxatriborinane.
Chemical Property Profile of Trifluoroboroxine
Property Insights of Trifluoroboroxine
The XLogP value of -0.087 indicates that Trifluoroboroxine is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 27.7 Ų, Trifluoroboroxine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Trifluoroboroxine has 0 hydrogen bond donor(s) and 6 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 Trifluoroboroxine?
The CAS number of Trifluoroboroxine is 13703-95-2.
What is the molecular formula of Trifluoroboroxine?
The molecular formula of Trifluoroboroxine is B3F3O3.
What is the molecular weight of Trifluoroboroxine?
The molecular weight of Trifluoroboroxine is 138.01 g/mol.
Where can I buy Trifluoroboroxine?
You can request a quote for Trifluoroboroxine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Trifluoroboroxine?
Yes, KEHONG BIO provides custom synthesis services for Trifluoroboroxine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.