1,3-Dichlorodibenzo-p-dioxin
TL;DR: 1,3-Dichlorodibenzo-p-dioxin (CAS 50585-39-2) is a chemical compound with molecular formula C12H6Cl2O2 and molecular weight 251.97449 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1,3-dichlorodibenzo-p-dioxin
Also Known As: 1,3-DICHLORODIBENZO-P-DIOXIN, 1,3-Dichlorodibenzo-para-dioxin, 1,3-DICHLOROOXANTHRENE, Dibenzo-p-dioxin, 1,3-dichloro-, PCDD 4
Technical Specifications
| Molecular Formula | C12H6Cl2O2 |
| Molecular Weight | 251.97449 g/mol |
| XLogP | 5.0 |
| Topological Polar Surface Area (TPSA) | 18.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 0 |
| Exact Mass | 251.97449 Da |
| Heavy Atoms | 16 |
| Complexity | 261.0 |
| SMILES | C1=CC=C2C(=C1)OC3=C(O2)C(=CC(=C3)Cl)Cl |
| InChIKey | AZYJYMAKTBXNSX-UHFFFAOYSA-N |
Chemical Property Profile of 1,3-Dichlorodibenzo-p-dioxin
Property Insights of 1,3-Dichlorodibenzo-p-dioxin
The XLogP value of 5.0 indicates that 1,3-Dichlorodibenzo-p-dioxin is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 18.5 Ų, 1,3-Dichlorodibenzo-p-dioxin exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1,3-Dichlorodibenzo-p-dioxin has 0 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of 1,3-Dichlorodibenzo-p-dioxin?
The CAS number of 1,3-Dichlorodibenzo-p-dioxin is 50585-39-2.
What is the molecular formula of 1,3-Dichlorodibenzo-p-dioxin?
The molecular formula of 1,3-Dichlorodibenzo-p-dioxin is C12H6Cl2O2.
What is the molecular weight of 1,3-Dichlorodibenzo-p-dioxin?
The molecular weight of 1,3-Dichlorodibenzo-p-dioxin is 251.97449 g/mol.
Where can I buy 1,3-Dichlorodibenzo-p-dioxin?
You can request a quote for 1,3-Dichlorodibenzo-p-dioxin directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 1,3-Dichlorodibenzo-p-dioxin?
Yes, CoreyChem provides custom synthesis services for 1,3-Dichlorodibenzo-p-dioxin and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.