2,5-Dioxooxolan-3-yl acetate
TL;DR: 2,5-Dioxooxolan-3-yl acetate (CAS 88918-76-7) is a chemical compound with molecular formula C6H6O5 and molecular weight 158.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2,5-dioxooxolan-3-yl) acetate
Also Known As: 2-O-Acetylmalic Anhydride, 2,5-DIOXOOXOLAN-3-YL ACETATE, 2,5-dioxotetrahydrofuran-3-yl acetate, Malic Anhydride Acetate, (2,5-dioxooxolan-3-yl) acetate
| Molecular Formula | C6H6O5 |
|---|---|
| Molecular Weight | 158.02 g/mol |
| LogP | -0.4 |
| Topological Polar Surface Area | 69.7 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 2 |
| Exact Mass | 158.02153 |
| Heavy Atoms | 11 |
| Complexity | 219.0 |
Chemical Identifiers
| CAS Number | 88918-76-7 |
|---|---|
| SMILES | CC(=O)OC1CC(=O)OC1=O |
| InChIKey | SSWJHSASZZAIAU-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 10 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2,5-Dioxooxolan-3-yl acetate (CAS 88918-76-7), with molecular formula C6H6O5 and molecular weight 158.02 g/mol. IUPAC: (2,5-dioxooxolan-3-yl) acetate.
Chemical Property Profile of 2,5-Dioxooxolan-3-yl acetate
Property Insights of 2,5-Dioxooxolan-3-yl acetate
The XLogP value of -0.4 indicates that 2,5-Dioxooxolan-3-yl acetate is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 69.7 Ų falls within the moderate polarity range, balancing permeability and solubility for 2,5-Dioxooxolan-3-yl acetate. Following Lipinski's Rule of Five, 2,5-Dioxooxolan-3-yl acetate has 0 hydrogen bond donor(s) and 5 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 2,5-Dioxooxolan-3-yl acetate?
The CAS number of 2,5-Dioxooxolan-3-yl acetate is 88918-76-7.
What is the molecular formula of 2,5-Dioxooxolan-3-yl acetate?
The molecular formula of 2,5-Dioxooxolan-3-yl acetate is C6H6O5.
What is the molecular weight of 2,5-Dioxooxolan-3-yl acetate?
The molecular weight of 2,5-Dioxooxolan-3-yl acetate is 158.02 g/mol.
Where can I buy 2,5-Dioxooxolan-3-yl acetate?
You can request a quote for 2,5-Dioxooxolan-3-yl acetate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2,5-Dioxooxolan-3-yl acetate?
Yes, KEHONG BIO provides custom synthesis services for 2,5-Dioxooxolan-3-yl acetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.