Octaethylporphyrinato-iron(III)perchlorate, monoimidazole adduct
TL;DR: Octaethylporphyrinato-iron(III)perchlorate, monoimidazole adduct (CAS 951-06-4) is a chemical compound with molecular formula C39H48ClFeN6O4 and molecular weight 755.28 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1H-imidazole;iron(3+);2,3,7,8,12,13,17,18-octaethylporphyrin-21,22-diide;perchlorate
Also Known As: Octaethylporphyrinato-iron(III)perchlorate, monoimidazole adduct, 1H-imidazole; iron(3+); 2,3,7,8,12,13,17,18-octaethylporphyrin-21,22-diide; perchlorate, Iron(1+), (1H-imidazole-N3)(2,3,7,8,12,13,17,18-octaethyl-21H,23H-porphinato(2-)-N21,N22,N23,N24)-, (SP-5-12)-, perchlorate, iron(3+) perchlorate 2,3,7,8,12,13,17,18-octaethylporphine-21,22-diide- 1h-imidazole(1:1:1:1)
| Molecular Formula | C39H48ClFeN6O4 |
|---|---|
| Molecular Weight | 755.28 g/mol |
| LogP | 4.9354 |
| Topological Polar Surface Area | 131.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 8 |
| Exact Mass | 755.27747 |
| Heavy Atoms | 51 |
| Complexity | 727.0 |
Chemical Identifiers
| CAS Number | 951-06-4 |
|---|---|
| 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.C1=CN=CN1.[O-]Cl(=O)(=O)=O.[Fe+3] |
| InChIKey | YRXKRAJMXNKFSY-UHFFFAOYSA-M |
Product Overview
Octaethylporphyrinato-iron(III)perchlorate, monoimidazole adduct (CAS 951-06-4), with molecular formula C39H48ClFeN6O4 and molecular weight 755.28 g/mol. IUPAC: 1H-imidazole;iron(3+);2,3,7,8,12,13,17,18-octaethylporphyrin-21,22-diide;perchlorate.
Chemical Property Profile of Octaethylporphyrinato-iron(III)perchlorate, monoimidazole adduct
Property Insights of Octaethylporphyrinato-iron(III)perchlorate, monoimidazole adduct
The XLogP value of 4.9354 indicates that Octaethylporphyrinato-iron(III)perchlorate, monoimidazole adduct is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 131.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Octaethylporphyrinato-iron(III)perchlorate, monoimidazole adduct. Following Lipinski's Rule of Five, Octaethylporphyrinato-iron(III)perchlorate, monoimidazole adduct has 1 hydrogen bond donor(s) and 9 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Octaethylporphyrinato-iron(III)perchlorate, monoimidazole adduct?
The CAS number of Octaethylporphyrinato-iron(III)perchlorate, monoimidazole adduct is 951-06-4.
What is the molecular formula of Octaethylporphyrinato-iron(III)perchlorate, monoimidazole adduct?
The molecular formula of Octaethylporphyrinato-iron(III)perchlorate, monoimidazole adduct is C39H48ClFeN6O4.
What is the molecular weight of Octaethylporphyrinato-iron(III)perchlorate, monoimidazole adduct?
The molecular weight of Octaethylporphyrinato-iron(III)perchlorate, monoimidazole adduct is 755.28 g/mol.
Where can I buy Octaethylporphyrinato-iron(III)perchlorate, monoimidazole adduct?
You can request a quote for Octaethylporphyrinato-iron(III)perchlorate, monoimidazole adduct directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Octaethylporphyrinato-iron(III)perchlorate, monoimidazole adduct?
Yes, KEHONG BIO provides custom synthesis services for Octaethylporphyrinato-iron(III)perchlorate, monoimidazole adduct and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.