5,7-Dioxooctanoic acid
TL;DR: 5,7-Dioxooctanoic acid (CAS 51568-19-5) is a chemical compound with molecular formula C8H12O4 and molecular weight 172.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5,7-dioxooctanoic acid
Also Known As: 5,7-Dioxooctanoic acid, Octanoic acid,5,7-dioxo, 5,7-diketo-octanoic acid, 5,7-DIOXOOCTANOICACID, Octanoic acid,5,7-dioxo-
| Molecular Formula | C8H12O4 |
|---|---|
| Molecular Weight | 172.07 g/mol |
| LogP | -0.4 |
| Topological Polar Surface Area | 71.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 172.07356 |
| Heavy Atoms | 12 |
| Complexity | 195.0 |
Chemical Identifiers
| CAS Number | 51568-19-5 |
|---|---|
| SMILES | CC(=O)CC(=O)CCCC(=O)O |
| InChIKey | JOQHEPMHRUHJFD-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
5,7-Dioxooctanoic acid (CAS 51568-19-5), with molecular formula C8H12O4 and molecular weight 172.07 g/mol. IUPAC: 5,7-dioxooctanoic acid.
Chemical Property Profile of 5,7-Dioxooctanoic acid
Property Insights of 5,7-Dioxooctanoic acid
The XLogP value of -0.4 indicates that 5,7-Dioxooctanoic 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 5,7-Dioxooctanoic acid. Following Lipinski's Rule of Five, 5,7-Dioxooctanoic 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 5,7-Dioxooctanoic acid?
The CAS number of 5,7-Dioxooctanoic acid is 51568-19-5.
What is the molecular formula of 5,7-Dioxooctanoic acid?
The molecular formula of 5,7-Dioxooctanoic acid is C8H12O4.
What is the molecular weight of 5,7-Dioxooctanoic acid?
The molecular weight of 5,7-Dioxooctanoic acid is 172.07 g/mol.
Where can I buy 5,7-Dioxooctanoic acid?
You can request a quote for 5,7-Dioxooctanoic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5,7-Dioxooctanoic acid?
Yes, KEHONG BIO provides custom synthesis services for 5,7-Dioxooctanoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.