2-乙基己酸铁(3+)盐(3:1)
TL;DR: 2-乙基己酸铁(3+)盐(3:1) (CAS 7321-53-1) is a chemical compound with molecular formula C24H45FeO6 and molecular weight 485.26 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-乙基己酸铁(3+)盐(3:1)
tris(2-ethylhexanoate);iron(3+)
Also Known As: Ferric 2-ethylhexanoate, iron octoate, Iron Ethylhexanoate, Iron 2-ethylhexanoate, 2-ethylhexanoate;iron(3+)
| Molecular Formula | C24H45FeO6 |
|---|---|
| Molecular Weight | 485.26 g/mol |
| LogP | 2.86 |
| Topological Polar Surface Area | 120.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 12 |
| Exact Mass | 485.25656 |
| Heavy Atoms | 31 |
| Complexity | 93.0 |
Chemical Identifiers
| CAS Number | 7321-53-1 |
|---|---|
| SMILES | CCCCC(CC)C(=O)[O-].CCCCC(CC)C(=O)[O-].CCCCC(CC)C(=O)[O-].[Fe+3] |
| InChIKey | ULUYRVWYCIOFRV-UHFFFAOYSA-K |
Patent-Derived Application Labels
Derived from 20 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2-乙基己酸铁(3+)盐(3:1) (CAS 7321-53-1), with molecular formula C24H45FeO6 and molecular weight 485.26 g/mol. IUPAC: tris(2-ethylhexanoate);iron(3+).
Chemical Property Profile of 2-乙基己酸铁(3+)盐(3:1)
Property Insights of 2-乙基己酸铁(3+)盐(3:1)
The XLogP value of 2.86 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-乙基己酸铁(3+)盐(3:1). The TPSA of 120.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-乙基己酸铁(3+)盐(3:1). Following Lipinski's Rule of Five, 2-乙基己酸铁(3+)盐(3:1) has 0 hydrogen bond donor(s) and 6 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 2-乙基己酸铁(3+)盐(3:1)?
The CAS number of 2-乙基己酸铁(3+)盐(3:1) is 7321-53-1.
What is the molecular formula of 2-乙基己酸铁(3+)盐(3:1)?
The molecular formula of 2-乙基己酸铁(3+)盐(3:1) is C24H45FeO6.
What is the molecular weight of 2-乙基己酸铁(3+)盐(3:1)?
The molecular weight of 2-乙基己酸铁(3+)盐(3:1) is 485.26 g/mol.
Where can I buy 2-乙基己酸铁(3+)盐(3:1)?
You can request a quote for 2-乙基己酸铁(3+)盐(3:1) directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-乙基己酸铁(3+)盐(3:1)?
Yes, KEHONG BIO provides custom synthesis services for 2-乙基己酸铁(3+)盐(3:1) and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.