5,9,12-Octadecatrienoicacid
TL;DR: 5,9,12-Octadecatrienoicacid (CAS 2441-53-4) is a chemical compound with molecular formula C18H30O2 and molecular weight 278.22 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
octadeca-5,9,12-trienoic acid
Also Known As: Pinolenic acid, Columbinic acid, Pinolenic acid [MI], 5,9,12-Octadecatrienoicacid, 5,9,12-octadecatrienic acid
| Molecular Formula | C18H30O2 |
|---|---|
| Molecular Weight | 278.22 g/mol |
| LogP | 5.6 |
| Topological Polar Surface Area | 37.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 13 |
| Exact Mass | 278.22458 |
| Heavy Atoms | 20 |
| Complexity | 301.0 |
Chemical Identifiers
| CAS Number | 2441-53-4 |
|---|---|
| SMILES | CCCCCC=CCC=CCCC=CCCCC(=O)O |
| InChIKey | HXQHFNIKBKZGRP-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 12 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
5,9,12-Octadecatrienoicacid (CAS 2441-53-4), with molecular formula C18H30O2 and molecular weight 278.22 g/mol. IUPAC: octadeca-5,9,12-trienoic acid.
Chemical Property Profile of 5,9,12-Octadecatrienoicacid
Property Insights of 5,9,12-Octadecatrienoicacid
The XLogP value of 5.6 indicates that 5,9,12-Octadecatrienoicacid is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 37.3 Ų, 5,9,12-Octadecatrienoicacid exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 5,9,12-Octadecatrienoicacid has 1 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 5,9,12-Octadecatrienoicacid?
The CAS number of 5,9,12-Octadecatrienoicacid is 2441-53-4.
What is the molecular formula of 5,9,12-Octadecatrienoicacid?
The molecular formula of 5,9,12-Octadecatrienoicacid is C18H30O2.
What is the molecular weight of 5,9,12-Octadecatrienoicacid?
The molecular weight of 5,9,12-Octadecatrienoicacid is 278.22 g/mol.
Where can I buy 5,9,12-Octadecatrienoicacid?
You can request a quote for 5,9,12-Octadecatrienoicacid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5,9,12-Octadecatrienoicacid?
Yes, KEHONG BIO provides custom synthesis services for 5,9,12-Octadecatrienoicacid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.