9,11-Octadecadiynoic acid
TL;DR: 9,11-Octadecadiynoic acid (CAS 33128-27-7) is a chemical compound with molecular formula C18H28O2 and molecular weight 276.21 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
octadeca-9,11-diynoic acid
Also Known As: 9,11-Octadecadiynoic acid, octadeca-9,11-diynoic acid, 9,11-Octadecadiyneoic acid, J2.201.642C, RefChem:107541
| Molecular Formula | C18H28O2 |
|---|---|
| Molecular Weight | 276.21 g/mol |
| LogP | 4.7789 |
| Topological Polar Surface Area | 37.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 11 |
| Exact Mass | 276.20892 |
| Heavy Atoms | 20 |
| Complexity | 349.08517 |
Chemical Identifiers
| CAS Number | 33128-27-7 |
|---|---|
| SMILES | CCCCCCC#CC#CCCCCCCCC(=O)O |
Product Overview
9,11-Octadecadiynoic acid (CAS 33128-27-7), with molecular formula C18H28O2 and molecular weight 276.21 g/mol. IUPAC: octadeca-9,11-diynoic acid.
Chemical Property Profile of 9,11-Octadecadiynoic acid
Property Insights of 9,11-Octadecadiynoic acid
The XLogP value of 4.7789 indicates that 9,11-Octadecadiynoic 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, 9,11-Octadecadiynoic acid exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 9,11-Octadecadiynoic 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 9,11-Octadecadiynoic acid?
The CAS number of 9,11-Octadecadiynoic acid is 33128-27-7.
What is the molecular formula of 9,11-Octadecadiynoic acid?
The molecular formula of 9,11-Octadecadiynoic acid is C18H28O2.
What is the molecular weight of 9,11-Octadecadiynoic acid?
The molecular weight of 9,11-Octadecadiynoic acid is 276.21 g/mol.
Where can I buy 9,11-Octadecadiynoic acid?
You can request a quote for 9,11-Octadecadiynoic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 9,11-Octadecadiynoic acid?
Yes, KEHONG BIO provides custom synthesis services for 9,11-Octadecadiynoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.