1-Chlorodibenzo-P-dioxin
TL;DR: 1-Chlorodibenzo-P-dioxin (CAS 39227-53-7) is a chemical compound with molecular formula C12H7ClO2 and molecular weight 218.01 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-chlorodibenzo-p-dioxin
Also Known As: 1-Chlorodibenzo-p-dioxin, 1-Chlorodibenzodioxin, 1-Chlorooxanthrene, 10-Chlorodecane, Dibenzo-p-dioxin, 1-chloro-
| Molecular Formula | C12H7ClO2 |
|---|---|
| Molecular Weight | 218.01 g/mol |
| LogP | 5.0 |
| Topological Polar Surface Area | 18.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 0 |
| Exact Mass | 218.01346 |
| Heavy Atoms | 15 |
| Complexity | 234.0 |
Chemical Identifiers
| CAS Number | 39227-53-7 |
|---|---|
| SMILES | C1=CC=C2C(=C1)OC3=C(O2)C(=CC=C3)Cl |
| InChIKey | VGGGRWRBGXENKI-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 14 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
1-Chlorodibenzo-P-dioxin (CAS 39227-53-7), with molecular formula C12H7ClO2 and molecular weight 218.01 g/mol. IUPAC: 1-chlorodibenzo-p-dioxin.
Chemical Property Profile of 1-Chlorodibenzo-P-dioxin
Property Insights of 1-Chlorodibenzo-P-dioxin
The XLogP value of 5.0 indicates that 1-Chlorodibenzo-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-Chlorodibenzo-P-dioxin exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-Chlorodibenzo-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
Frequently Asked Questions
What is the CAS number of 1-Chlorodibenzo-P-dioxin?
The CAS number of 1-Chlorodibenzo-P-dioxin is 39227-53-7.
What is the molecular formula of 1-Chlorodibenzo-P-dioxin?
The molecular formula of 1-Chlorodibenzo-P-dioxin is C12H7ClO2.
What is the molecular weight of 1-Chlorodibenzo-P-dioxin?
The molecular weight of 1-Chlorodibenzo-P-dioxin is 218.01 g/mol.
Where can I buy 1-Chlorodibenzo-P-dioxin?
You can request a quote for 1-Chlorodibenzo-P-dioxin directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-Chlorodibenzo-P-dioxin?
Yes, KEHONG BIO provides custom synthesis services for 1-Chlorodibenzo-P-dioxin and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.