4,5-Dioxopentanoic acid
TL;DR: 4,5-Dioxopentanoic acid (CAS 5976-90-9) is a chemical compound with molecular formula C5H6O4 and molecular weight 130.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4,5-dioxopentanoic acid
Also Known As: 4,5-Dioxopentanoic acid, 4,5-Dioxovaleric acid, 4,5-Dioxopentanoate, gamma,delta-Dioxovalerate, 4-Oxoglutarate semialdehyde
| Molecular Formula | C5H6O4 |
|---|---|
| Molecular Weight | 130.03 g/mol |
| LogP | -1.0 |
| Topological Polar Surface Area | 71.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 130.02661 |
| Heavy Atoms | 9 |
| Complexity | 138.0 |
Chemical Identifiers
| CAS Number | 5976-90-9 |
|---|---|
| SMILES | C(CC(=O)O)C(=O)C=O |
| InChIKey | YHUFRVYVNKGICT-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 1 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
4,5-Dioxopentanoic acid (CAS 5976-90-9), with molecular formula C5H6O4 and molecular weight 130.03 g/mol. IUPAC: 4,5-dioxopentanoic acid.
Chemical Property Profile of 4,5-Dioxopentanoic acid
Property Insights of 4,5-Dioxopentanoic acid
The XLogP value of -1.0 indicates that 4,5-Dioxopentanoic acid is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 71.4 Ų falls within the moderate polarity range, balancing permeability and solubility for 4,5-Dioxopentanoic acid. Following Lipinski's Rule of Five, 4,5-Dioxopentanoic acid has 1 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 4,5-Dioxopentanoic acid?
The CAS number of 4,5-Dioxopentanoic acid is 5976-90-9.
What is the molecular formula of 4,5-Dioxopentanoic acid?
The molecular formula of 4,5-Dioxopentanoic acid is C5H6O4.
What is the molecular weight of 4,5-Dioxopentanoic acid?
The molecular weight of 4,5-Dioxopentanoic acid is 130.03 g/mol.
Where can I buy 4,5-Dioxopentanoic acid?
You can request a quote for 4,5-Dioxopentanoic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4,5-Dioxopentanoic acid?
Yes, KEHONG BIO provides custom synthesis services for 4,5-Dioxopentanoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.