2-Methylicosa-8,12,14-trienoic acid
TL;DR: 2-Methylicosa-8,12,14-trienoic acid (CAS 97516-41-1) is a chemical compound with molecular formula C21H36O2 and molecular weight 320.27 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-methylicosa-8,12,14-trienoic acid
Also Known As: 2-Methyl-8,12,14-eita, 2-methylicosa-8,12,14-trienoic acid, 2-Methyl-8,12,14-eicosatrienoic acid, 8,12,14-Eicosatrienoicacid, 2-methyl-, (8Z,12E,14Z)-
| Molecular Formula | C21H36O2 |
|---|---|
| Molecular Weight | 320.27 g/mol |
| LogP | 7.5 |
| Topological Polar Surface Area | 37.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 15 |
| Exact Mass | 320.27155 |
| Heavy Atoms | 23 |
| Complexity | 353.0 |
Chemical Identifiers
| CAS Number | 97516-41-1 |
|---|---|
| SMILES | CCCCCC=CC=CCCC=CCCCCCC(C)C(=O)O |
| InChIKey | MHPNICBSCYTRJI-UHFFFAOYSA-N |
Product Overview
2-Methylicosa-8,12,14-trienoic acid (CAS 97516-41-1), with molecular formula C21H36O2 and molecular weight 320.27 g/mol. IUPAC: 2-methylicosa-8,12,14-trienoic acid.
Chemical Property Profile of 2-Methylicosa-8,12,14-trienoic acid
Property Insights of 2-Methylicosa-8,12,14-trienoic acid
The XLogP value of 7.5 indicates that 2-Methylicosa-8,12,14-trienoic acid is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 37.3 Ų, 2-Methylicosa-8,12,14-trienoic acid exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Methylicosa-8,12,14-trienoic acid 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 2-Methylicosa-8,12,14-trienoic acid?
The CAS number of 2-Methylicosa-8,12,14-trienoic acid is 97516-41-1.
What is the molecular formula of 2-Methylicosa-8,12,14-trienoic acid?
The molecular formula of 2-Methylicosa-8,12,14-trienoic acid is C21H36O2.
What is the molecular weight of 2-Methylicosa-8,12,14-trienoic acid?
The molecular weight of 2-Methylicosa-8,12,14-trienoic acid is 320.27 g/mol.
Where can I buy 2-Methylicosa-8,12,14-trienoic acid?
You can request a quote for 2-Methylicosa-8,12,14-trienoic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Methylicosa-8,12,14-trienoic acid?
Yes, KEHONG BIO provides custom synthesis services for 2-Methylicosa-8,12,14-trienoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.