TL;DR: Iron maleate (CAS 101672-15-5) is a chemical compound with molecular formula C4H2FeO4 and molecular weight 169.93024 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(Z)-but-2-enedioate;iron(2+)
Also Known As: Ferrous fumarate, Ercoferro, Ferrocite, Ferrofume, Ferronat
| Molecular Formula | C4H2FeO4 |
| Molecular Weight | 169.93024 g/mol |
| XLogP | -2.9601 |
| Topological Polar Surface Area (TPSA) | 80.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 0 |
| Exact Mass | 169.93024 Da |
| Heavy Atoms | 9 |
| Complexity | 108.0 |
| SMILES | C(=C\C(=O)[O-])\C(=O)[O-].[Fe+2] |
| InChIKey | PMVSDNDAUGGCCE-ODZAUARKSA-L |
The XLogP value of -2.9601 indicates that Iron maleate is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 80.3 Ų falls within the moderate polarity range, balancing permeability and solubility for Iron maleate. Following Lipinski's Rule of Five, Iron maleate has 0 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of Iron maleate is 101672-15-5.
The molecular formula of Iron maleate is C4H2FeO4.
The molecular weight of Iron maleate is 169.93024 g/mol.
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