Octachlorodibenzofuran
TL;DR: Octachlorodibenzofuran (CAS 39001-02-0) is a chemical compound with molecular formula C12Cl8O and molecular weight 439.75 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1,2,3,4,6,7,8,9-octachlorodibenzofuran
Also Known As: OCTACHLORODIBENZOFURAN, Perchlorodibenzofuran, OCDF, 1,2,3,4,6,7,8,9-Octachlorodibenzofuran, Dibenzofuran, octachloro-
| Molecular Formula | C12Cl8O |
|---|---|
| Molecular Weight | 439.75 g/mol |
| LogP | 8.5 |
| Topological Polar Surface Area | 13.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 0 |
| Exact Mass | 443.73984 |
| Heavy Atoms | 21 |
| Complexity | 375.0 |
Chemical Identifiers
| CAS Number | 39001-02-0 |
|---|---|
| SMILES | C12=C(C(=C(C(=C1Cl)Cl)Cl)Cl)OC3=C2C(=C(C(=C3Cl)Cl)Cl)Cl |
| InChIKey | RHIROFAGUQOFLU-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 10 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Octachlorodibenzofuran (CAS 39001-02-0), with molecular formula C12Cl8O and molecular weight 439.75 g/mol. IUPAC: 1,2,3,4,6,7,8,9-octachlorodibenzofuran.
Chemical Property Profile of Octachlorodibenzofuran
Property Insights of Octachlorodibenzofuran
The XLogP value of 8.5 indicates that Octachlorodibenzofuran is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 13.1 Ų, Octachlorodibenzofuran exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Octachlorodibenzofuran 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 Octachlorodibenzofuran?
The CAS number of Octachlorodibenzofuran is 39001-02-0.
What is the molecular formula of Octachlorodibenzofuran?
The molecular formula of Octachlorodibenzofuran is C12Cl8O.
What is the molecular weight of Octachlorodibenzofuran?
The molecular weight of Octachlorodibenzofuran is 439.75 g/mol.
Where can I buy Octachlorodibenzofuran?
You can request a quote for Octachlorodibenzofuran directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Octachlorodibenzofuran?
Yes, KEHONG BIO provides custom synthesis services for Octachlorodibenzofuran and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.