Oxane-2,4-dione
TL;DR: Oxane-2,4-dione (CAS 33532-46-6) is a chemical compound with molecular formula C5H6O3 and molecular weight 114.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
oxane-2,4-dione
Also Known As: Oxane-2,4-dione, Dihydro-2H-pyran-2,4(3H)-dione, tetrahydropyran-2,4-dione, 4-oxotetrahydropyranone, Tetrahydro-2H-pyran-2,4-dione
| Molecular Formula | C5H6O3 |
|---|---|
| Molecular Weight | 114.03 g/mol |
| LogP | -0.1075 |
| Topological Polar Surface Area | 43.37 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 0 |
| Exact Mass | 114.03169 |
| Heavy Atoms | 8 |
| Complexity | 113.635475 |
Chemical Identifiers
| CAS Number | 33532-46-6 |
|---|---|
| SMILES | C1COC(=O)CC1=O |
Product Overview
Oxane-2,4-dione (CAS 33532-46-6), with molecular formula C5H6O3 and molecular weight 114.03 g/mol. IUPAC: oxane-2,4-dione.
Chemical Property Profile of Oxane-2,4-dione
Property Insights of Oxane-2,4-dione
The XLogP value of -0.1075 indicates that Oxane-2,4-dione is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 43.37 Ų, Oxane-2,4-dione exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Oxane-2,4-dione has 0 hydrogen bond donor(s) and 3 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 Oxane-2,4-dione?
The CAS number of Oxane-2,4-dione is 33532-46-6.
What is the molecular formula of Oxane-2,4-dione?
The molecular formula of Oxane-2,4-dione is C5H6O3.
What is the molecular weight of Oxane-2,4-dione?
The molecular weight of Oxane-2,4-dione is 114.03 g/mol.
Where can I buy Oxane-2,4-dione?
You can request a quote for Oxane-2,4-dione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Oxane-2,4-dione?
Yes, KEHONG BIO provides custom synthesis services for Oxane-2,4-dione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.