1,3,8-Trichlorodibenzofuran
TL;DR: 1,3,8-Trichlorodibenzofuran (CAS 76621-12-0) is a chemical compound with molecular formula C12H5Cl3O and molecular weight 269.9406 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1,3,8-trichlorodibenzofuran
Also Known As: 1,3,8-TRICHLORODIBENZOFURAN, Dibenzofuran, 1,3,8-trichloro, PCDF 30, 1,3,8-Trichlorodibenzo[b,d]furan, 3,5,12-trichloro-8-oxatricyclo(7.4.0.02,7)trideca-1(13),2,4,6,9,11-hexaene
Application Areas
Top 5 of 3 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C12H5Cl3O |
| Molecular Weight | 269.9406 g/mol |
| XLogP | 5.7 |
| Topological Polar Surface Area (TPSA) | 13.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 0 |
| Exact Mass | 269.9406 Da |
| Heavy Atoms | 16 |
| Complexity | 273.0 |
| SMILES | C1=CC2=C(C=C1Cl)C3=C(O2)C=C(C=C3Cl)Cl |
| InChIKey | PHFSTDOPTZHECA-UHFFFAOYSA-N |
Chemical Property Profile of 1,3,8-Trichlorodibenzofuran
Property Insights of 1,3,8-Trichlorodibenzofuran
The XLogP value of 5.7 indicates that 1,3,8-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, 1,3,8-Trichlorodibenzofuran exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1,3,8-Trichlorodibenzofuran has 0 hydrogen bond donor(s) and 1 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
What is the CAS number of 1,3,8-Trichlorodibenzofuran?
The CAS number of 1,3,8-Trichlorodibenzofuran is 76621-12-0.
What is the molecular formula of 1,3,8-Trichlorodibenzofuran?
The molecular formula of 1,3,8-Trichlorodibenzofuran is C12H5Cl3O.
What is the molecular weight of 1,3,8-Trichlorodibenzofuran?
The molecular weight of 1,3,8-Trichlorodibenzofuran is 269.9406 g/mol.
Where can I buy 1,3,8-Trichlorodibenzofuran?
You can request a quote for 1,3,8-Trichlorodibenzofuran directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 1,3,8-Trichlorodibenzofuran?
Yes, CoreyChem provides custom synthesis services for 1,3,8-Trichlorodibenzofuran and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.