iron(3+);(9Z,12Z)-octadeca-9,12-dienoate
TL;DR: iron(3+);(9Z,12Z)-octadeca-9,12-dienoate (CAS 68109-59-1) is a chemical compound with molecular formula C18H31FeO2+2 and molecular weight 335.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
iron(3+);(9Z,12Z)-octadeca-9,12-dienoate
Also Known As: Iron(III) linoleate, C18H32O2.1/3Fe, C18-H32-O2.1/3Fe, iron(3+); (9Z,12Z)-octadeca-9,12-dienoate, 9,12-Octadecadienoic acid (9Z,12Z)-, iron(3+) salt
| Molecular Formula | C18H31FeO2+2 |
|---|---|
| Molecular Weight | 335.17 g/mol |
| LogP | 4.5473 |
| Topological Polar Surface Area | 40.13 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 14 |
| Exact Mass | 335.16733 |
| Heavy Atoms | 21 |
| Complexity | 272.3919 |
Chemical Identifiers
| CAS Number | 68109-59-1 |
|---|---|
| SMILES | CCCCC/C=C\C/C=C\CCCCCCCC(=O)[O-].[Fe+3] |
Product Overview
iron(3+);(9Z,12Z)-octadeca-9,12-dienoate (CAS 68109-59-1), with molecular formula C18H31FeO2+2 and molecular weight 335.17 g/mol. IUPAC: iron(3+);(9Z,12Z)-octadeca-9,12-dienoate.
Chemical Property Profile of iron(3+);(9Z,12Z)-octadeca-9,12-dienoate
Property Insights of iron(3+);(9Z,12Z)-octadeca-9,12-dienoate
The XLogP value of 4.5473 indicates that iron(3+);(9Z,12Z)-octadeca-9,12-dienoate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 40.13 Ų, iron(3+);(9Z,12Z)-octadeca-9,12-dienoate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, iron(3+);(9Z,12Z)-octadeca-9,12-dienoate has 0 hydrogen bond donor(s) and 2 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 iron(3+);(9Z,12Z)-octadeca-9,12-dienoate?
The CAS number of iron(3+);(9Z,12Z)-octadeca-9,12-dienoate is 68109-59-1.
What is the molecular formula of iron(3+);(9Z,12Z)-octadeca-9,12-dienoate?
The molecular formula of iron(3+);(9Z,12Z)-octadeca-9,12-dienoate is C18H31FeO2+2.
What is the molecular weight of iron(3+);(9Z,12Z)-octadeca-9,12-dienoate?
The molecular weight of iron(3+);(9Z,12Z)-octadeca-9,12-dienoate is 335.17 g/mol.
Where can I buy iron(3+);(9Z,12Z)-octadeca-9,12-dienoate?
You can request a quote for iron(3+);(9Z,12Z)-octadeca-9,12-dienoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for iron(3+);(9Z,12Z)-octadeca-9,12-dienoate?
Yes, KEHONG BIO provides custom synthesis services for iron(3+);(9Z,12Z)-octadeca-9,12-dienoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.