Sodium hydrogen ferric diethylenetriaminepentacetate
TL;DR: Sodium hydrogen ferric diethylenetriaminepentacetate (CAS 12389-75-2) is a chemical compound with molecular formula C14H19FeN3NaO10 and molecular weight 468.03174 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
sodium;2-[2-[bis(carboxylatomethyl)amino]ethyl-[2-[carboxylatomethyl(carboxymethyl)amino]ethyl]amino]acetate;iron(3+)
Also Known As: DTPA-FE-11, SODIUM HYDROGEN FERRIC DTPA, Sodium hydrogen ferric diethylenetriaminepentacetate, EC 235-627-0, I14-20244
Technical Specifications
| Molecular Formula | C14H19FeN3NaO10 |
| Molecular Weight | 468.03174 g/mol |
| XLogP | -11.02 |
| Topological Polar Surface Area (TPSA) | 208.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 13 |
| Rotatable Bonds | 12 |
| Exact Mass | 468.03174 Da |
| Heavy Atoms | 29 |
| Complexity | 515.0 |
| SMILES | C(CN(CC(=O)O)CC(=O)[O-])N(CCN(CC(=O)[O-])CC(=O)[O-])CC(=O)[O-].[Na+].[Fe+3] |
| InChIKey | UEHRTZASQAWUOJ-UHFFFAOYSA-J |
Chemical Property Profile of Sodium hydrogen ferric diethylenetriaminepentacetate
Property Insights of Sodium hydrogen ferric diethylenetriaminepentacetate
The XLogP value of -11.02 indicates that Sodium hydrogen ferric diethylenetriaminepentacetate is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 208.0 Ų indicates high polarity, suggesting Sodium hydrogen ferric diethylenetriaminepentacetate may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Sodium hydrogen ferric diethylenetriaminepentacetate has 1 hydrogen bond donor(s) and 13 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
What is the CAS number of Sodium hydrogen ferric diethylenetriaminepentacetate?
The CAS number of Sodium hydrogen ferric diethylenetriaminepentacetate is 12389-75-2.
What is the molecular formula of Sodium hydrogen ferric diethylenetriaminepentacetate?
The molecular formula of Sodium hydrogen ferric diethylenetriaminepentacetate is C14H19FeN3NaO10.
What is the molecular weight of Sodium hydrogen ferric diethylenetriaminepentacetate?
The molecular weight of Sodium hydrogen ferric diethylenetriaminepentacetate is 468.03174 g/mol.
Where can I buy Sodium hydrogen ferric diethylenetriaminepentacetate?
You can request a quote for Sodium hydrogen ferric diethylenetriaminepentacetate directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Sodium hydrogen ferric diethylenetriaminepentacetate?
Yes, CoreyChem provides custom synthesis services for Sodium hydrogen ferric diethylenetriaminepentacetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.