Ethyl 3-oxododecanoate
TL;DR: Ethyl 3-oxododecanoate (CAS 67342-99-8) is a chemical compound with molecular formula C14H26O3 and molecular weight 242.19 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 3-oxododecanoate
Also Known As: Ethyl 3-oxododecanoate, ethyl3-oxododecanoate, ethyl-3-oxododecanoate, Dodecanoic acid, 3-oxo-, ethyl ester, 3-Oxododecanoic acid ethyl ester
| Molecular Formula | C14H26O3 |
|---|---|
| Molecular Weight | 242.19 g/mol |
| LogP | 3.6494 |
| Topological Polar Surface Area | 43.37 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 11 |
| Exact Mass | 242.1882 |
| Heavy Atoms | 17 |
| Complexity | 211.51286 |
Chemical Identifiers
| CAS Number | 67342-99-8 |
|---|---|
| SMILES | CCCCCCCCCC(=O)CC(=O)OCC |
Product Overview
Ethyl 3-oxododecanoate (CAS 67342-99-8), with molecular formula C14H26O3 and molecular weight 242.19 g/mol. IUPAC: ethyl 3-oxododecanoate.
Chemical Property Profile of Ethyl 3-oxododecanoate
Property Insights of Ethyl 3-oxododecanoate
The XLogP value of 3.6494 indicates that Ethyl 3-oxododecanoate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 43.37 Ų, Ethyl 3-oxododecanoate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Ethyl 3-oxododecanoate has 0 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 Ethyl 3-oxododecanoate?
The CAS number of Ethyl 3-oxododecanoate is 67342-99-8.
What is the molecular formula of Ethyl 3-oxododecanoate?
The molecular formula of Ethyl 3-oxododecanoate is C14H26O3.
What is the molecular weight of Ethyl 3-oxododecanoate?
The molecular weight of Ethyl 3-oxododecanoate is 242.19 g/mol.
Where can I buy Ethyl 3-oxododecanoate?
You can request a quote for Ethyl 3-oxododecanoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ethyl 3-oxododecanoate?
Yes, KEHONG BIO provides custom synthesis services for Ethyl 3-oxododecanoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.