Ethyl beta-eleostearate
TL;DR: Ethyl beta-eleostearate (CAS 42021-86-3) is a chemical compound with molecular formula C20H34O2 and molecular weight 306.26 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl (9E,11E,13E)-octadeca-9,11,13-trienoate
Also Known As: Ethyl beta-eleostearate, A-Ethyleleostearat, A-eleostearic acid ethyl ester, ETHYL .BETA.-ELEOSTEARATE, 9(Z),11(E),13(E)-Octadecatrienoic Acid ethyl ester
| Molecular Formula | C20H34O2 |
|---|---|
| Molecular Weight | 306.26 g/mol |
| LogP | 6.139 |
| Topological Polar Surface Area | 26.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 14 |
| Exact Mass | 306.2559 |
| Heavy Atoms | 22 |
| Complexity | 326.59894 |
Chemical Identifiers
| CAS Number | 42021-86-3 |
|---|---|
| SMILES | CCCC/C=C/C=C/C=C/CCCCCCCC(=O)OCC |
Product Overview
Ethyl beta-eleostearate (CAS 42021-86-3), with molecular formula C20H34O2 and molecular weight 306.26 g/mol. IUPAC: ethyl (9E,11E,13E)-octadeca-9,11,13-trienoate.
Chemical Property Profile of Ethyl beta-eleostearate
Property Insights of Ethyl beta-eleostearate
The XLogP value of 6.139 indicates that Ethyl beta-eleostearate 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 beta-eleostearate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Ethyl beta-eleostearate 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 Ethyl beta-eleostearate?
The CAS number of Ethyl beta-eleostearate is 42021-86-3.
What is the molecular formula of Ethyl beta-eleostearate?
The molecular formula of Ethyl beta-eleostearate is C20H34O2.
What is the molecular weight of Ethyl beta-eleostearate?
The molecular weight of Ethyl beta-eleostearate is 306.26 g/mol.
Where can I buy Ethyl beta-eleostearate?
You can request a quote for Ethyl beta-eleostearate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ethyl beta-eleostearate?
Yes, KEHONG BIO provides custom synthesis services for Ethyl beta-eleostearate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.