TL;DR: Butanedioic acid, 2-(1,2-dicarboxyethoxy)-3-hydroxy-, tetrasodium salt (CAS 111451-13-9) is a chemical compound with molecular formula C8H6Na4O10 and molecular weight 353.95517 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
tetrasodium;2-(1,2-dicarboxylatoethoxy)-3-hydroxybutanedioate
Also Known As: Sodium tartrate monosuccinate, 2-(1,2-DICARBOXYETHOXY)-3-HYDROXYBUTANEDIOIC ACID, Butanedioic acid, 2-(1,2-dicarboxyethoxy)-3-hydroxy-, tetrasodium salt, tetrasodium;2-(1,2-dicarboxylatoethoxy)-3-hydroxybutanedioate, 2-(1,2-Dicarboxyethoxy)-3-hydroxybutanedioic acid tetrasodium salt
| Molecular Formula | C8H6Na4O10 |
| Molecular Weight | 353.95517 g/mol |
| XLogP | -19.49 |
| Topological Polar Surface Area (TPSA) | 190.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 10 |
| Rotatable Bonds | 4 |
| Exact Mass | 353.95517 Da |
| Heavy Atoms | 22 |
| Complexity | 339.0 |
| SMILES | C(C(C(=O)[O-])OC(C(C(=O)[O-])O)C(=O)[O-])C(=O)[O-].[Na+].[Na+].[Na+].[Na+] |
| InChIKey | GYUMVVCVCCHJOA-UHFFFAOYSA-J |
The XLogP value of -19.49 indicates that Butanedioic acid, 2-(1,2-dicarboxyethoxy)-3-hydroxy-, tetrasodium salt is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 190.0 Ų indicates high polarity, suggesting Butanedioic acid, 2-(1,2-dicarboxyethoxy)-3-hydroxy-, tetrasodium salt may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Butanedioic acid, 2-(1,2-dicarboxyethoxy)-3-hydroxy-, tetrasodium salt has 1 hydrogen bond donor(s) and 10 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of Butanedioic acid, 2-(1,2-dicarboxyethoxy)-3-hydroxy-, tetrasodium salt is 111451-13-9.
The molecular formula of Butanedioic acid, 2-(1,2-dicarboxyethoxy)-3-hydroxy-, tetrasodium salt is C8H6Na4O10.
The molecular weight of Butanedioic acid, 2-(1,2-dicarboxyethoxy)-3-hydroxy-, tetrasodium salt is 353.95517 g/mol.
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