1,3,9-Trichlorodibenzofuran
TL;DR: 1,3,9-Trichlorodibenzofuran (CAS 83704-40-9) 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.
1,3,9-trichlorodibenzofuran
Also Known As: 1,3,9-TRICHLORODIBENZOFURAN, Dibenzofuran, 1,3,9-trichloro, Dibenzofuran, 1,3,9-trichloro-, 1,3,9-trichlorodibenzo[b,d]furan, 3,5,13-trichloro-8-oxatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene
| Molecular Formula | C12H5Cl3O |
|---|---|
| Molecular Weight | 269.94 g/mol |
| LogP | 5.3 |
| 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 | 83704-40-9 |
|---|---|
| SMILES | C1=CC2=C(C(=C1)Cl)C3=C(O2)C=C(C=C3Cl)Cl |
| InChIKey | SPPGDLROKBFNNO-UHFFFAOYSA-N |
Product Overview
1,3,9-Trichlorodibenzofuran (CAS 83704-40-9), with molecular formula C12H5Cl3O and molecular weight 269.94 g/mol. IUPAC: 1,3,9-trichlorodibenzofuran.
Chemical Property Profile of 1,3,9-Trichlorodibenzofuran
Property Insights of 1,3,9-Trichlorodibenzofuran
The XLogP value of 5.3 indicates that 1,3,9-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, 1,3,9-Trichlorodibenzofuran exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1,3,9-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 1,3,9-Trichlorodibenzofuran?
The CAS number of 1,3,9-Trichlorodibenzofuran is 83704-40-9.
What is the molecular formula of 1,3,9-Trichlorodibenzofuran?
The molecular formula of 1,3,9-Trichlorodibenzofuran is C12H5Cl3O.
What is the molecular weight of 1,3,9-Trichlorodibenzofuran?
The molecular weight of 1,3,9-Trichlorodibenzofuran is 269.94 g/mol.
Where can I buy 1,3,9-Trichlorodibenzofuran?
You can request a quote for 1,3,9-Trichlorodibenzofuran directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,3,9-Trichlorodibenzofuran?
Yes, KEHONG BIO provides custom synthesis services for 1,3,9-Trichlorodibenzofuran and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.