Ethyl octadec-9-enoate
TL;DR: Ethyl octadec-9-enoate (CAS 111-62-6) is a chemical compound with molecular formula C20H38O2 and molecular weight 310.28717 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
ethyl octadec-9-enoate
Also Known As: Ethyl oleate, ethyl octadec-9-enoate, Ethyl elaidate, Ethylis oleas, Oleic acid ethyl ester
Application Areas
Top 5 of 22 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C20H38O2 |
| Molecular Weight | 310.28717 g/mol |
| XLogP | 8.0 |
| Topological Polar Surface Area (TPSA) | 26.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 17 |
| Exact Mass | 310.28717 Da |
| Heavy Atoms | 22 |
| Complexity | 258.0 |
| SMILES | CCCCCCCCC=CCCCCCCCC(=O)OCC |
| InChIKey | LVGKNOAMLMIIKO-UHFFFAOYSA-N |
Product Description
Applications: Ethyl octadec-9-enoate is used in pharmaceutical synthesis routes and API production, as well as heterocycle construction in medicinal chemistry and agrochemical discovery. It commonly serves as a versatile building block for organic synthesis. Available from CoreyChem as both catalog item and custom-synthesis project (mg to ton scale), with full analytical documentation (COA, MSDS, HPLC, NMR, MS).
Ethyl octadec-9-enoate (CAS 111-62-6) is a pharmaceutical intermediate with the molecular formula C20H38O2 and a molecular weight of 310.29 g/mol. Synonyms include Ethyl oleate and ethyl octadec-9-enoate.
Custom synthesis and full analytical documentation (COA/MSDS) are available from CoreyChem. Request a quotation with your required quantity and purity for current lead time and pricing.
Chemical Property Profile of Ethyl octadec-9-enoate
Property Insights of Ethyl octadec-9-enoate
The XLogP value of 8.0 indicates that Ethyl octadec-9-enoate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 26.3 Ų, Ethyl octadec-9-enoate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Ethyl octadec-9-enoate has 0 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
What is the CAS number of Ethyl octadec-9-enoate?
The CAS number of Ethyl octadec-9-enoate is 111-62-6.
What is the molecular formula of Ethyl octadec-9-enoate?
The molecular formula of Ethyl octadec-9-enoate is C20H38O2.
What is the molecular weight of Ethyl octadec-9-enoate?
The molecular weight of Ethyl octadec-9-enoate is 310.28717 g/mol.
What are the applications of Ethyl octadec-9-enoate?
Ethyl octadec-9-enoate is used in pharmaceutical synthesis routes and API production, as well as heterocycle construction in medicinal chemistry and agrochemical discovery. It commonly serves as a versatile building block for organic synthesis. Available from CoreyChem as both catalog item and...
Where can I buy Ethyl octadec-9-enoate?
You can request a quote for Ethyl octadec-9-enoate directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Ethyl octadec-9-enoate?
Yes, CoreyChem provides custom synthesis services for Ethyl octadec-9-enoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.