TL;DR: Gadolinium oxalate (CAS 100655-00-3) is a chemical compound with molecular formula C6Gd2O12 and molecular weight 579.7872 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
bis(gadolinium(3+));oxalate
Also Known As: Gadolinium oxalate, ethanedioic acid, gadolinium(3+);oxalate, GADOLINIUMOXALATE, gadolinium oxalate hydrate
Top 5 of 10 IPC patent classification(s) from the SureChEMBL global patent database.
| Molecular Formula | C6Gd2O12 |
| Molecular Weight | 579.7872 g/mol |
| XLogP | -10.5414 |
| Topological Polar Surface Area (TPSA) | 241.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 12 |
| Rotatable Bonds | 0 |
| Exact Mass | 579.7872 Da |
| Heavy Atoms | 20 |
| Complexity | 60.0 |
| SMILES | C(=O)(C(=O)[O-])[O-].C(=O)(C(=O)[O-])[O-].C(=O)(C(=O)[O-])[O-].[Gd+3].[Gd+3] |
| InChIKey | SQORATIMOBOFKR-UHFFFAOYSA-H |
The XLogP value of -10.5414 indicates that Gadolinium oxalate is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 241.0 Ų indicates high polarity, suggesting Gadolinium oxalate may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Gadolinium oxalate has 0 hydrogen bond donor(s) and 12 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
The CAS number of Gadolinium oxalate is 100655-00-3.
The molecular formula of Gadolinium oxalate is C6Gd2O12.
The molecular weight of Gadolinium oxalate is 579.7872 g/mol.
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