Octadec-9-enyl octanoate
TL;DR: Octadec-9-enyl octanoate (CAS 19149-86-1) is a chemical compound with molecular formula C26H50O2 and molecular weight 394.38 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
octadec-9-enyl octanoate
Also Known As: oleyl caprylate, Oleyl octanoate, Octanoic acid,(9Z)-9-octadecen-1-yl ester
| Molecular Formula | C26H50O2 |
|---|---|
| Molecular Weight | 394.38 g/mol |
| LogP | 11.0 |
| Topological Polar Surface Area | 26.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 23 |
| Exact Mass | 394.38107 |
| Heavy Atoms | 28 |
| Complexity | 335.0 |
Chemical Identifiers
| CAS Number | 19149-86-1 |
|---|---|
| SMILES | CCCCCCCCC=CCCCCCCCCOC(=O)CCCCCCC |
| InChIKey | DFHRKKNQGGEVPA-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 10 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Octadec-9-enyl octanoate (CAS 19149-86-1), with molecular formula C26H50O2 and molecular weight 394.38 g/mol. IUPAC: octadec-9-enyl octanoate.
Chemical Property Profile of Octadec-9-enyl octanoate
Property Insights of Octadec-9-enyl octanoate
The XLogP value of 11.0 indicates that Octadec-9-enyl octanoate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 26.3 Ų, Octadec-9-enyl octanoate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Octadec-9-enyl octanoate has 0 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Octadec-9-enyl octanoate?
The CAS number of Octadec-9-enyl octanoate is 19149-86-1.
What is the molecular formula of Octadec-9-enyl octanoate?
The molecular formula of Octadec-9-enyl octanoate is C26H50O2.
What is the molecular weight of Octadec-9-enyl octanoate?
The molecular weight of Octadec-9-enyl octanoate is 394.38 g/mol.
Where can I buy Octadec-9-enyl octanoate?
You can request a quote for Octadec-9-enyl octanoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Octadec-9-enyl octanoate?
Yes, KEHONG BIO provides custom synthesis services for Octadec-9-enyl octanoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.