Octaethylporphyrinatoiron(III)perchlorate
TL;DR: Octaethylporphyrinatoiron(III)perchlorate (CAS 5452-32-4) is a chemical compound with molecular formula C36H44ClFeN4O4 and molecular weight 687.24 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
iron(3+);2,3,7,8,12,13,17,18-octaethylporphyrin-21,22-diide;perchlorate
Also Known As: Oep-Fe(III)clo4, Octaethylporphyrinatoiron(III)perchlorate, iron(3+);2,3,7,8,12,13,17,18-octaethylporphyrin-21,22-diide;perchlorate, iron(3+) perchlorate 2,3,7,8,12,13,17,18-octaethylporphine-21,22-diide(1:1:1), iron(3+); 2,3,7,8,12,13,17,18-octaethylporphyrin-21,22-diide; perchlorate
| Molecular Formula | C36H44ClFeN4O4 |
|---|---|
| Molecular Weight | 687.24 g/mol |
| LogP | 4.5257 |
| Topological Polar Surface Area | 102.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 8 |
| Exact Mass | 687.24005 |
| Heavy Atoms | 46 |
| Complexity | 699.0 |
Chemical Identifiers
| CAS Number | 5452-32-4 |
|---|---|
| SMILES | CCC1=C(C2=CC3=NC(=CC4=NC(=CC5=C(C(=C([N-]5)C=C1[N-]2)CC)CC)C(=C4CC)CC)C(=C3CC)CC)CC.[O-]Cl(=O)(=O)=O.[Fe+3] |
| InChIKey | MWBOLLOAHYJQAU-UHFFFAOYSA-M |
Product Overview
Octaethylporphyrinatoiron(III)perchlorate (CAS 5452-32-4), with molecular formula C36H44ClFeN4O4 and molecular weight 687.24 g/mol. IUPAC: iron(3+);2,3,7,8,12,13,17,18-octaethylporphyrin-21,22-diide;perchlorate.
Chemical Property Profile of Octaethylporphyrinatoiron(III)perchlorate
Property Insights of Octaethylporphyrinatoiron(III)perchlorate
The XLogP value of 4.5257 indicates that Octaethylporphyrinatoiron(III)perchlorate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 102.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Octaethylporphyrinatoiron(III)perchlorate. Following Lipinski's Rule of Five, Octaethylporphyrinatoiron(III)perchlorate has 0 hydrogen bond donor(s) and 8 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Octaethylporphyrinatoiron(III)perchlorate?
The CAS number of Octaethylporphyrinatoiron(III)perchlorate is 5452-32-4.
What is the molecular formula of Octaethylporphyrinatoiron(III)perchlorate?
The molecular formula of Octaethylporphyrinatoiron(III)perchlorate is C36H44ClFeN4O4.
What is the molecular weight of Octaethylporphyrinatoiron(III)perchlorate?
The molecular weight of Octaethylporphyrinatoiron(III)perchlorate is 687.24 g/mol.
Where can I buy Octaethylporphyrinatoiron(III)perchlorate?
You can request a quote for Octaethylporphyrinatoiron(III)perchlorate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Octaethylporphyrinatoiron(III)perchlorate?
Yes, KEHONG BIO provides custom synthesis services for Octaethylporphyrinatoiron(III)perchlorate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.