3-Oxoundecanoic acid
TL;DR: 3-Oxoundecanoic acid (CAS 4435-85-2) is a chemical compound with molecular formula C11H20O3 and molecular weight 200.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-oxoundecanoic acid
Also Known As: 3-oxoundecanoic acid, 3-Oxo-undecanoic acid, Pelargonyl acetic acid, ss-Ketoundecylsaure, undecanoic acid, 3-oxo-
| Molecular Formula | C11H20O3 |
|---|---|
| Molecular Weight | 200.14 g/mol |
| LogP | 3.2 |
| Topological Polar Surface Area | 54.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 9 |
| Exact Mass | 200.14125 |
| Heavy Atoms | 14 |
| Complexity | 175.0 |
Chemical Identifiers
| CAS Number | 4435-85-2 |
|---|---|
| SMILES | CCCCCCCCC(=O)CC(=O)O |
| InChIKey | RYAXOIRSQGWHQD-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 7 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
3-Oxoundecanoic acid (CAS 4435-85-2), with molecular formula C11H20O3 and molecular weight 200.14 g/mol. IUPAC: 3-oxoundecanoic acid.
Chemical Property Profile of 3-Oxoundecanoic acid
Property Insights of 3-Oxoundecanoic acid
The XLogP value of 3.2 indicates that 3-Oxoundecanoic acid is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 54.4 Ų, 3-Oxoundecanoic acid exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-Oxoundecanoic acid has 1 hydrogen bond donor(s) and 3 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-Oxoundecanoic acid?
The CAS number of 3-Oxoundecanoic acid is 4435-85-2.
What is the molecular formula of 3-Oxoundecanoic acid?
The molecular formula of 3-Oxoundecanoic acid is C11H20O3.
What is the molecular weight of 3-Oxoundecanoic acid?
The molecular weight of 3-Oxoundecanoic acid is 200.14 g/mol.
Where can I buy 3-Oxoundecanoic acid?
You can request a quote for 3-Oxoundecanoic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-Oxoundecanoic acid?
Yes, KEHONG BIO provides custom synthesis services for 3-Oxoundecanoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.