Aquapentacyanoferrate
TL;DR: Aquapentacyanoferrate (CAS 14100-31-3) is a chemical compound with molecular formula C5H2FeN5Na3O and molecular weight 272.93 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
trisodium;iron(2+);pentacyanide;hydrate
Also Known As: Aquapentacyanoferrate, Aquopentacyanoferrate, iron(5+);pentacyanide;hydrate, trisodium iron(2+) pentacyanide hydrate, (OC-6-22)-Trisodium aquapentakis(cyano-C)ferrate(3-)
| Molecular Formula | C5H2FeN5Na3O |
|---|---|
| Molecular Weight | 272.93 g/mol |
| LogP | -9.33335 |
| Topological Polar Surface Area | 150.45 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 0 |
| Exact Mass | 272.93018 |
| Heavy Atoms | 15 |
| Complexity | 89.23255 |
Chemical Identifiers
| CAS Number | 14100-31-3 |
|---|---|
| SMILES | [C-]#N.[C-]#N.[C-]#N.[C-]#N.[C-]#N.O.[Na+].[Na+].[Na+].[Fe+2] |
Product Overview
Aquapentacyanoferrate (CAS 14100-31-3), with molecular formula C5H2FeN5Na3O and molecular weight 272.93 g/mol. IUPAC: trisodium;iron(2+);pentacyanide;hydrate.
Chemical Property Profile of Aquapentacyanoferrate
Property Insights of Aquapentacyanoferrate
The XLogP value of -9.33335 indicates that Aquapentacyanoferrate is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 150.45 Ų indicates high polarity, suggesting Aquapentacyanoferrate may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Aquapentacyanoferrate has 0 hydrogen bond donor(s) and 5 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 Aquapentacyanoferrate?
The CAS number of Aquapentacyanoferrate is 14100-31-3.
What is the molecular formula of Aquapentacyanoferrate?
The molecular formula of Aquapentacyanoferrate is C5H2FeN5Na3O.
What is the molecular weight of Aquapentacyanoferrate?
The molecular weight of Aquapentacyanoferrate is 272.93 g/mol.
Where can I buy Aquapentacyanoferrate?
You can request a quote for Aquapentacyanoferrate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Aquapentacyanoferrate?
Yes, KEHONG BIO provides custom synthesis services for Aquapentacyanoferrate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.