7,10,13-Hexadecatrienoic acid methyl ester
TL;DR: 7,10,13-Hexadecatrienoic acid methyl ester (CAS 77388-16-0) is a chemical compound with molecular formula C17H28O2 and molecular weight 264.21 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl hexadeca-7,10,13-trienoate
Also Known As: methyl 7,10,13-hexadecatrienoate, METHYL HEXADECA-7,10,13-TRIENOATE, 7,10,13-HEXADECATRIENOIC ACID METHYL ESTER, 7,10,13-Hexadecatrienoic acid, methyl ester, Methyl (7(Z), 10(Z), 13(Z))-Hexadecatrienoate
| Molecular Formula | C17H28O2 |
|---|---|
| Molecular Weight | 264.21 g/mol |
| LogP | 5.1 |
| Topological Polar Surface Area | 26.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 12 |
| Exact Mass | 264.20892 |
| Heavy Atoms | 19 |
| Complexity | 288.0 |
Chemical Identifiers
| CAS Number | 77388-16-0 |
|---|---|
| SMILES | CCC=CCC=CCC=CCCCCCC(=O)OC |
| InChIKey | DUOCBVNCDAEWTB-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 4 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
7,10,13-Hexadecatrienoic acid methyl ester (CAS 77388-16-0), with molecular formula C17H28O2 and molecular weight 264.21 g/mol. IUPAC: methyl hexadeca-7,10,13-trienoate.
Chemical Property Profile of 7,10,13-Hexadecatrienoic acid methyl ester
Property Insights of 7,10,13-Hexadecatrienoic acid methyl ester
The XLogP value of 5.1 indicates that 7,10,13-Hexadecatrienoic 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, 7,10,13-Hexadecatrienoic acid methyl ester exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 7,10,13-Hexadecatrienoic 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 7,10,13-Hexadecatrienoic acid methyl ester?
The CAS number of 7,10,13-Hexadecatrienoic acid methyl ester is 77388-16-0.
What is the molecular formula of 7,10,13-Hexadecatrienoic acid methyl ester?
The molecular formula of 7,10,13-Hexadecatrienoic acid methyl ester is C17H28O2.
What is the molecular weight of 7,10,13-Hexadecatrienoic acid methyl ester?
The molecular weight of 7,10,13-Hexadecatrienoic acid methyl ester is 264.21 g/mol.
Where can I buy 7,10,13-Hexadecatrienoic acid methyl ester?
You can request a quote for 7,10,13-Hexadecatrienoic 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 7,10,13-Hexadecatrienoic acid methyl ester?
Yes, KEHONG BIO provides custom synthesis services for 7,10,13-Hexadecatrienoic acid methyl ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.