9,12,15-Octadecatrien-6-ynoic acid
TL;DR: 9,12,15-Octadecatrien-6-ynoic acid (CAS 61481-30-9) is a chemical compound with molecular formula C18H26O2 and molecular weight 274.19 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(9E,12E,15E)-octadeca-9,12,15-trien-6-ynoic acid
Also Known As: Dicranin, 9,12,15-Octadecatrien-6-ynoic acid, (9E,12E,15E)-octadeca-9,12,15-trien-6-ynoic acid
| Molecular Formula | C18H26O2 |
|---|---|
| Molecular Weight | 274.19 g/mol |
| LogP | 4.8837 |
| Topological Polar Surface Area | 37.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 10 |
| Exact Mass | 274.19327 |
| Heavy Atoms | 20 |
| Complexity | 377.95773 |
Chemical Identifiers
| CAS Number | 61481-30-9 |
|---|---|
| SMILES | CC/C=C/C/C=C/C/C=C/CC#CCCCCC(=O)O |
Product Overview
9,12,15-Octadecatrien-6-ynoic acid (CAS 61481-30-9), with molecular formula C18H26O2 and molecular weight 274.19 g/mol. IUPAC: (9E,12E,15E)-octadeca-9,12,15-trien-6-ynoic acid.
Chemical Property Profile of 9,12,15-Octadecatrien-6-ynoic acid
Property Insights of 9,12,15-Octadecatrien-6-ynoic acid
The XLogP value of 4.8837 indicates that 9,12,15-Octadecatrien-6-ynoic 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, 9,12,15-Octadecatrien-6-ynoic acid exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 9,12,15-Octadecatrien-6-ynoic acid has 1 hydrogen bond donor(s) and 1 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 9,12,15-Octadecatrien-6-ynoic acid?
The CAS number of 9,12,15-Octadecatrien-6-ynoic acid is 61481-30-9.
What is the molecular formula of 9,12,15-Octadecatrien-6-ynoic acid?
The molecular formula of 9,12,15-Octadecatrien-6-ynoic acid is C18H26O2.
What is the molecular weight of 9,12,15-Octadecatrien-6-ynoic acid?
The molecular weight of 9,12,15-Octadecatrien-6-ynoic acid is 274.19 g/mol.
Where can I buy 9,12,15-Octadecatrien-6-ynoic acid?
You can request a quote for 9,12,15-Octadecatrien-6-ynoic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 9,12,15-Octadecatrien-6-ynoic acid?
Yes, KEHONG BIO provides custom synthesis services for 9,12,15-Octadecatrien-6-ynoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.