1,4-Dioxane-2,6-dione
TL;DR: 1,4-Dioxane-2,6-dione (CAS 4480-83-5) is a chemical compound with molecular formula C4H4O4 and molecular weight 116.01 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1,4-dioxane-2,6-dione
Also Known As: Diglycolic anhydride, 1,4-Dioxane-2,6-dione, Diglycolicanhydride, Oxydiacetic anhydride, p-Dioxane-2,6-dione
| Molecular Formula | C4H4O4 |
|---|---|
| Molecular Weight | 116.01 g/mol |
| LogP | -0.4 |
| Topological Polar Surface Area | 52.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 0 |
| Exact Mass | 116.010956 |
| Heavy Atoms | 8 |
| Complexity | 114.0 |
Chemical Identifiers
| CAS Number | 4480-83-5 |
|---|---|
| SMILES | C1C(=O)OC(=O)CO1 |
| InChIKey | PIYNUZCGMLCXKJ-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 11 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
1,4-Dioxane-2,6-dione (CAS 4480-83-5), with molecular formula C4H4O4 and molecular weight 116.01 g/mol. IUPAC: 1,4-dioxane-2,6-dione.
Chemical Property Profile of 1,4-Dioxane-2,6-dione
Property Insights of 1,4-Dioxane-2,6-dione
The XLogP value of -0.4 indicates that 1,4-Dioxane-2,6-dione is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 52.6 Ų, 1,4-Dioxane-2,6-dione exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1,4-Dioxane-2,6-dione has 0 hydrogen bond donor(s) and 4 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-Dioxane-2,6-dione?
The CAS number of 1,4-Dioxane-2,6-dione is 4480-83-5.
What is the molecular formula of 1,4-Dioxane-2,6-dione?
The molecular formula of 1,4-Dioxane-2,6-dione is C4H4O4.
What is the molecular weight of 1,4-Dioxane-2,6-dione?
The molecular weight of 1,4-Dioxane-2,6-dione is 116.01 g/mol.
Where can I buy 1,4-Dioxane-2,6-dione?
You can request a quote for 1,4-Dioxane-2,6-dione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,4-Dioxane-2,6-dione?
Yes, KEHONG BIO provides custom synthesis services for 1,4-Dioxane-2,6-dione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.