Ferric nitrilotriacetate
TL;DR: Ferric nitrilotriacetate (CAS 16448-54-7) is a chemical compound with molecular formula C6H6FeNO6 and molecular weight 243.95 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[bis(carboxylatomethyl)amino]acetate;iron(3+)
Also Known As: Ferric nitrilotriacetate, Iron nitrilotriacetate, Iron(3+) NTA, Fe-NTA, FeNAc3
| Molecular Formula | C6H6FeNO6 |
|---|---|
| Molecular Weight | 243.95 g/mol |
| LogP | -5.46 |
| Topological Polar Surface Area | 124.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 3 |
| Exact Mass | 243.95445 |
| Heavy Atoms | 14 |
| Complexity | 171.0 |
Chemical Identifiers
| CAS Number | 16448-54-7 |
|---|---|
| SMILES | C(C(=O)[O-])N(CC(=O)[O-])CC(=O)[O-].[Fe+3] |
| InChIKey | FXDLIMJMHVKXAR-UHFFFAOYSA-K |
Patent-Derived Application Labels
Derived from 12 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Ferric nitrilotriacetate (CAS 16448-54-7), with molecular formula C6H6FeNO6 and molecular weight 243.95 g/mol. IUPAC: 2-[bis(carboxylatomethyl)amino]acetate;iron(3+).
Chemical Property Profile of Ferric nitrilotriacetate
Property Insights of Ferric nitrilotriacetate
The XLogP value of -5.46 indicates that Ferric nitrilotriacetate is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 124.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Ferric nitrilotriacetate. Following Lipinski's Rule of Five, Ferric nitrilotriacetate has 0 hydrogen bond donor(s) and 7 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 Ferric nitrilotriacetate?
The CAS number of Ferric nitrilotriacetate is 16448-54-7.
What is the molecular formula of Ferric nitrilotriacetate?
The molecular formula of Ferric nitrilotriacetate is C6H6FeNO6.
What is the molecular weight of Ferric nitrilotriacetate?
The molecular weight of Ferric nitrilotriacetate is 243.95 g/mol.
Where can I buy Ferric nitrilotriacetate?
You can request a quote for Ferric nitrilotriacetate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ferric nitrilotriacetate?
Yes, KEHONG BIO provides custom synthesis services for Ferric nitrilotriacetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.