Octadecadienoic acid, methyl ester
TL;DR: Octadecadienoic acid, methyl ester (CAS 89577-59-3) is a chemical compound with molecular formula C19H34O2 and molecular weight 294.26 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl octadeca-2,4-dienoate
Also Known As: Octadecadienoic acid, methyl ester, octadecadienoic acid methyl ester, Methyl (2E,4E)-octadeca-2,4-dienoate, METHYL OCTADECA-2,4-DIENOATE, Octadecadienoic acid, methyl ester, (Z,Z)-
| Molecular Formula | C19H34O2 |
|---|---|
| Molecular Weight | 294.26 g/mol |
| LogP | 8.0 |
| Topological Polar Surface Area | 26.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 15 |
| Exact Mass | 294.2559 |
| Heavy Atoms | 21 |
| Complexity | 279.0 |
Chemical Identifiers
| CAS Number | 89577-59-3 |
|---|---|
| SMILES | CCCCCCCCCCCCCC=CC=CC(=O)OC |
| InChIKey | NYSGGOVWVWBZAA-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 7 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Octadecadienoic acid, methyl ester (CAS 89577-59-3), with molecular formula C19H34O2 and molecular weight 294.26 g/mol. IUPAC: methyl octadeca-2,4-dienoate.
Chemical Property Profile of Octadecadienoic acid, methyl ester
Property Insights of Octadecadienoic acid, methyl ester
The XLogP value of 8.0 indicates that Octadecadienoic acid, methyl ester is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 26.3 Ų, Octadecadienoic acid, methyl ester exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Octadecadienoic acid, methyl ester 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 Octadecadienoic acid, methyl ester?
The CAS number of Octadecadienoic acid, methyl ester is 89577-59-3.
What is the molecular formula of Octadecadienoic acid, methyl ester?
The molecular formula of Octadecadienoic acid, methyl ester is C19H34O2.
What is the molecular weight of Octadecadienoic acid, methyl ester?
The molecular weight of Octadecadienoic acid, methyl ester is 294.26 g/mol.
Where can I buy Octadecadienoic acid, methyl ester?
You can request a quote for Octadecadienoic acid, methyl ester directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Octadecadienoic acid, methyl ester?
Yes, KEHONG BIO provides custom synthesis services for Octadecadienoic acid, methyl ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.