2,4,8-Trichlorodibenzofuran
TL;DR: 2,4,8-Trichlorodibenzofuran (CAS 54589-71-8) is a chemical compound with molecular formula C12H5Cl3O and molecular weight 269.94 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2,4,8-trichlorodibenzofuran
Also Known As: 2,4,8-TRICHLORODIBENZOFURAN, Triclosan Impurity 2, Triclosan Impurity 7, Dibenzofuran, 2,4,8-trichloro-, 2,4,8-trichlorodibenzo[b,d]furan
| Molecular Formula | C12H5Cl3O |
|---|---|
| Molecular Weight | 269.94 g/mol |
| LogP | 6.1 |
| Topological Polar Surface Area | 13.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 0 |
| Exact Mass | 269.9406 |
| Heavy Atoms | 16 |
| Complexity | 273.0 |
Chemical Identifiers
| CAS Number | 54589-71-8 |
|---|---|
| SMILES | C1=CC2=C(C=C1Cl)C3=C(O2)C(=CC(=C3)Cl)Cl |
| InChIKey | WJURXKWTCOMRCE-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 4 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2,4,8-Trichlorodibenzofuran (CAS 54589-71-8), with molecular formula C12H5Cl3O and molecular weight 269.94 g/mol. IUPAC: 2,4,8-trichlorodibenzofuran.
Chemical Property Profile of 2,4,8-Trichlorodibenzofuran
Property Insights of 2,4,8-Trichlorodibenzofuran
The XLogP value of 6.1 indicates that 2,4,8-Trichlorodibenzofuran is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 13.1 Ų, 2,4,8-Trichlorodibenzofuran exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2,4,8-Trichlorodibenzofuran has 0 hydrogen bond donor(s) and 1 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 2,4,8-Trichlorodibenzofuran?
The CAS number of 2,4,8-Trichlorodibenzofuran is 54589-71-8.
What is the molecular formula of 2,4,8-Trichlorodibenzofuran?
The molecular formula of 2,4,8-Trichlorodibenzofuran is C12H5Cl3O.
What is the molecular weight of 2,4,8-Trichlorodibenzofuran?
The molecular weight of 2,4,8-Trichlorodibenzofuran is 269.94 g/mol.
Where can I buy 2,4,8-Trichlorodibenzofuran?
You can request a quote for 2,4,8-Trichlorodibenzofuran directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2,4,8-Trichlorodibenzofuran?
Yes, KEHONG BIO provides custom synthesis services for 2,4,8-Trichlorodibenzofuran and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.