2-Acetoxysuccinic acid
TL;DR: 2-Acetoxysuccinic acid (CAS 85319-64-8) is a chemical compound with molecular formula C6H8O6 and molecular weight 176.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-acetyloxybutanedioic acid
Also Known As: acetylmalic acid, O-acetylmalicacid, acetyl-dl-malic acid, L-acetoxysuccinic acid, 2-Acetoxysuccinic acid
| Molecular Formula | C6H8O6 |
|---|---|
| Molecular Weight | 176.03 g/mol |
| LogP | -0.8 |
| Topological Polar Surface Area | 101.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 176.03209 |
| Heavy Atoms | 12 |
| Complexity | 208.0 |
Chemical Identifiers
| CAS Number | 85319-64-8 |
|---|---|
| SMILES | CC(=O)OC(CC(=O)O)C(=O)O |
| InChIKey | UYVRPHIVOKUAPF-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 9 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2-Acetoxysuccinic acid (CAS 85319-64-8), with molecular formula C6H8O6 and molecular weight 176.03 g/mol. IUPAC: 2-acetyloxybutanedioic acid.
Chemical Property Profile of 2-Acetoxysuccinic acid
Property Insights of 2-Acetoxysuccinic acid
The XLogP value of -0.8 indicates that 2-Acetoxysuccinic acid is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 101.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-Acetoxysuccinic acid. Following Lipinski's Rule of Five, 2-Acetoxysuccinic acid has 2 hydrogen bond donor(s) and 6 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-Acetoxysuccinic acid?
The CAS number of 2-Acetoxysuccinic acid is 85319-64-8.
What is the molecular formula of 2-Acetoxysuccinic acid?
The molecular formula of 2-Acetoxysuccinic acid is C6H8O6.
What is the molecular weight of 2-Acetoxysuccinic acid?
The molecular weight of 2-Acetoxysuccinic acid is 176.03 g/mol.
Where can I buy 2-Acetoxysuccinic acid?
You can request a quote for 2-Acetoxysuccinic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Acetoxysuccinic acid?
Yes, KEHONG BIO provides custom synthesis services for 2-Acetoxysuccinic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.