Trichloroboroxin
TL;DR: Trichloroboroxin (CAS 13703-91-8) is a chemical compound with molecular formula B3Cl3O3 and molecular weight 185.92 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2,4,6-trichloro-1,3,5,2,4,6-trioxatriborinane
Also Known As: Trichloroboroxin, chloroboroxole, Boroxin, trichloro-, B3O3Cl3, Boroxin,2,4,6-trichloro-
| Molecular Formula | B3Cl3O3 |
|---|---|
| Molecular Weight | 185.92 g/mol |
| LogP | 0.7209 |
| Topological Polar Surface Area | 27.7 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 0 |
| Exact Mass | 185.91922 |
| Heavy Atoms | 9 |
| Complexity | 69.0 |
Chemical Identifiers
| CAS Number | 13703-91-8 |
|---|---|
| SMILES | B1(OB(OB(O1)Cl)Cl)Cl |
| InChIKey | VBYYWJQDWARHPF-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 1 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Trichloroboroxin (CAS 13703-91-8), with molecular formula B3Cl3O3 and molecular weight 185.92 g/mol. IUPAC: 2,4,6-trichloro-1,3,5,2,4,6-trioxatriborinane.
Chemical Property Profile of Trichloroboroxin
Property Insights of Trichloroboroxin
The XLogP value of 0.7209 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Trichloroboroxin. With a topological polar surface area (TPSA) of 27.7 Ų, Trichloroboroxin exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Trichloroboroxin 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 Trichloroboroxin?
The CAS number of Trichloroboroxin is 13703-91-8.
What is the molecular formula of Trichloroboroxin?
The molecular formula of Trichloroboroxin is B3Cl3O3.
What is the molecular weight of Trichloroboroxin?
The molecular weight of Trichloroboroxin is 185.92 g/mol.
Where can I buy Trichloroboroxin?
You can request a quote for Trichloroboroxin directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Trichloroboroxin?
Yes, KEHONG BIO provides custom synthesis services for Trichloroboroxin and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.