9-cis,11-trans-Octadecadienoic acid
TL;DR: 9-cis,11-trans-Octadecadienoic acid (CAS 54739-30-9) is a chemical compound with molecular formula C18H32O2 and molecular weight 280.24 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(9Z,11E)-octadeca-9,11-dienoic acid
Also Known As: Bovinic acid, Rumenic acid, (9Z,11E)-octadeca-9,11-dienoic acid, cis-9, trans-11 CLA, (9Z,11E)-Octadecadienoic acid
| Molecular Formula | C18H32O2 |
|---|---|
| Molecular Weight | 280.24 g/mol |
| LogP | 5.8845 |
| Topological Polar Surface Area | 37.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 14 |
| Exact Mass | 280.24023 |
| Heavy Atoms | 20 |
| Complexity | 266.5918 |
Chemical Identifiers
| CAS Number | 54739-30-9 |
|---|---|
| SMILES | CCCCCC/C=C/C=C\CCCCCCCC(=O)O |
Product Overview
9-cis,11-trans-Octadecadienoic acid (CAS 54739-30-9), with molecular formula C18H32O2 and molecular weight 280.24 g/mol. IUPAC: (9Z,11E)-octadeca-9,11-dienoic acid.
Chemical Property Profile of 9-cis,11-trans-Octadecadienoic acid
Property Insights of 9-cis,11-trans-Octadecadienoic acid
The XLogP value of 5.8845 indicates that 9-cis,11-trans-Octadecadienoic 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-cis,11-trans-Octadecadienoic acid exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 9-cis,11-trans-Octadecadienoic acid has 1 hydrogen bond donor(s) and 1 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 9-cis,11-trans-Octadecadienoic acid?
The CAS number of 9-cis,11-trans-Octadecadienoic acid is 54739-30-9.
What is the molecular formula of 9-cis,11-trans-Octadecadienoic acid?
The molecular formula of 9-cis,11-trans-Octadecadienoic acid is C18H32O2.
What is the molecular weight of 9-cis,11-trans-Octadecadienoic acid?
The molecular weight of 9-cis,11-trans-Octadecadienoic acid is 280.24 g/mol.
Where can I buy 9-cis,11-trans-Octadecadienoic acid?
You can request a quote for 9-cis,11-trans-Octadecadienoic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 9-cis,11-trans-Octadecadienoic acid?
Yes, KEHONG BIO provides custom synthesis services for 9-cis,11-trans-Octadecadienoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.