3-Oxononanoic acid
TL;DR: 3-Oxononanoic acid (CAS 40435-57-2) is a chemical compound with molecular formula C9H16O3 and molecular weight 172.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-oxononanoic acid
Also Known As: 3-oxononanoic acid, 3-Ketopelargonic acid, 3-oxo-nonanoic acid, ss-Oxopelargonsaure
| Molecular Formula | C9H16O3 |
|---|---|
| Molecular Weight | 172.11 g/mol |
| LogP | 2.0006 |
| Topological Polar Surface Area | 54.37 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 7 |
| Exact Mass | 172.10994 |
| Heavy Atoms | 12 |
| Complexity | 151.85263 |
Chemical Identifiers
| CAS Number | 40435-57-2 |
|---|---|
| SMILES | CCCCCCC(=O)CC(=O)O |
Product Overview
3-Oxononanoic acid (CAS 40435-57-2), with molecular formula C9H16O3 and molecular weight 172.11 g/mol. IUPAC: 3-oxononanoic acid.
Chemical Property Profile of 3-Oxononanoic acid
Property Insights of 3-Oxononanoic acid
The XLogP value of 2.0006 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-Oxononanoic acid. With a topological polar surface area (TPSA) of 54.37 Ų, 3-Oxononanoic acid exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-Oxononanoic acid has 1 hydrogen bond donor(s) and 2 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 3-Oxononanoic acid?
The CAS number of 3-Oxononanoic acid is 40435-57-2.
What is the molecular formula of 3-Oxononanoic acid?
The molecular formula of 3-Oxononanoic acid is C9H16O3.
What is the molecular weight of 3-Oxononanoic acid?
The molecular weight of 3-Oxononanoic acid is 172.11 g/mol.
Where can I buy 3-Oxononanoic acid?
You can request a quote for 3-Oxononanoic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-Oxononanoic acid?
Yes, KEHONG BIO provides custom synthesis services for 3-Oxononanoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.