6-Octadecynoic acid, methyl ester
TL;DR: 6-Octadecynoic acid, methyl ester (CAS 2777-64-2) 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 octadec-6-ynoate
Also Known As: methyl octadec-6-ynoate, Methyl 6-octadecynoate, 6-Octadecynoic acid, methyl ester, 6-Octadecynoic acid methyl ester
| Molecular Formula | C19H34O2 |
|---|---|
| Molecular Weight | 294.26 g/mol |
| LogP | 7.3 |
| Topological Polar Surface Area | 26.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 14 |
| Exact Mass | 294.2559 |
| Heavy Atoms | 21 |
| Complexity | 295.0 |
Chemical Identifiers
| CAS Number | 2777-64-2 |
|---|---|
| SMILES | CCCCCCCCCCCC#CCCCCC(=O)OC |
| InChIKey | BQMKDXICMFVULI-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 1 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
6-Octadecynoic acid, methyl ester (CAS 2777-64-2), with molecular formula C19H34O2 and molecular weight 294.26 g/mol. IUPAC: methyl octadec-6-ynoate.
Chemical Property Profile of 6-Octadecynoic acid, methyl ester
Property Insights of 6-Octadecynoic acid, methyl ester
The XLogP value of 7.3 indicates that 6-Octadecynoic 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, 6-Octadecynoic acid, methyl ester exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 6-Octadecynoic 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 6-Octadecynoic acid, methyl ester?
The CAS number of 6-Octadecynoic acid, methyl ester is 2777-64-2.
What is the molecular formula of 6-Octadecynoic acid, methyl ester?
The molecular formula of 6-Octadecynoic acid, methyl ester is C19H34O2.
What is the molecular weight of 6-Octadecynoic acid, methyl ester?
The molecular weight of 6-Octadecynoic acid, methyl ester is 294.26 g/mol.
Where can I buy 6-Octadecynoic acid, methyl ester?
You can request a quote for 6-Octadecynoic 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 6-Octadecynoic acid, methyl ester?
Yes, KEHONG BIO provides custom synthesis services for 6-Octadecynoic acid, methyl ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.