TL;DR: iminodiacetic acid-ruthenium (III) complex (CAS 117676-57-0) is a chemical compound with molecular formula C8H16Cl3N2O9Ru and molecular weight 490.89648 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
bis(2-(carboxylatomethylamino)acetate);hydron;ruthenium(3+);trichloride;hydrate
Also Known As: Ru-Idaa, Iminodiacetic acid-ruthenium (III) complex, Ruthenium (III)-iminodiacetic acid complex, 1-METHYL-INDAZOLE-5-CARBOXYLIC ACID, Aquabis(N-(carboxymethyl)glycinato(2-)-N)trichlororuthenate(4-) tetrahydrogen
| Molecular Formula | C8H16Cl3N2O9Ru |
| Molecular Weight | 490.89648 g/mol |
| XLogP | -17.2136 |
| Topological Polar Surface Area (TPSA) | 186.0 Ų |
| Hydrogen Bond Donors | 7 |
| Hydrogen Bond Acceptors | 14 |
| Rotatable Bonds | 4 |
| Exact Mass | 490.89648 Da |
| Heavy Atoms | 23 |
| Complexity | 96.0 |
| SMILES | [H+].[H+].[H+].[H+].C(C(=O)[O-])NCC(=O)[O-].C(C(=O)[O-])NCC(=O)[O-].O.[Cl-].[Cl-].[Cl-].[Ru+3] |
| InChIKey | PLIDZBKUOMINIO-UHFFFAOYSA-K |
The XLogP value of -17.2136 indicates that iminodiacetic acid-ruthenium (III) complex is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 186.0 Ų indicates high polarity, suggesting iminodiacetic acid-ruthenium (III) complex may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, iminodiacetic acid-ruthenium (III) complex has 7 hydrogen bond donor(s) and 14 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
The CAS number of iminodiacetic acid-ruthenium (III) complex is 117676-57-0.
The molecular formula of iminodiacetic acid-ruthenium (III) complex is C8H16Cl3N2O9Ru.
The molecular weight of iminodiacetic acid-ruthenium (III) complex is 490.89648 g/mol.
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