1,4-Dioxyl radical
TL;DR: 1,4-Dioxyl radical (CAS 4598-47-4) is a chemical compound with molecular formula C4H7O2 and molecular weight 87.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
Also Known As: 1,4-Dioxyl radical, 1,4-dioxanyl, 1,4-dioxan-2-yl, 2,5-dioxacyclohexyl radical, (1,4-Dioxane-2-yl)radical
| Molecular Formula | C4H7O2 |
|---|---|
| Molecular Weight | 87.04 g/mol |
| LogP | -0.3 |
| Topological Polar Surface Area | 18.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 0 |
| Exact Mass | 87.0446 |
| Heavy Atoms | 6 |
| Complexity | 36.0 |
Chemical Identifiers
| CAS Number | 4598-47-4 |
|---|---|
| SMILES | C1CO[CH]CO1 |
| InChIKey | XTKIUJCPLLOSMW-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 21 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
1,4-Dioxyl radical (CAS 4598-47-4), with molecular formula C4H7O2 and molecular weight 87.04 g/mol.
Chemical Property Profile of 1,4-Dioxyl radical
Property Insights of 1,4-Dioxyl radical
The XLogP value of -0.3 indicates that 1,4-Dioxyl radical is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 18.5 Ų, 1,4-Dioxyl radical exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1,4-Dioxyl radical 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 1,4-Dioxyl radical?
The CAS number of 1,4-Dioxyl radical is 4598-47-4.
What is the molecular formula of 1,4-Dioxyl radical?
The molecular formula of 1,4-Dioxyl radical is C4H7O2.
What is the molecular weight of 1,4-Dioxyl radical?
The molecular weight of 1,4-Dioxyl radical is 87.04 g/mol.
Where can I buy 1,4-Dioxyl radical?
You can request a quote for 1,4-Dioxyl radical directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,4-Dioxyl radical?
Yes, KEHONG BIO provides custom synthesis services for 1,4-Dioxyl radical and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.