TL;DR: 1,4-Butanedisulfonic acid, 1,4-dihydroxy-, sodium salt (1:2) (CAS 5450-96-4) is a chemical compound with molecular formula C4H8Na2O8S2 and molecular weight 293.9456 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
disodium;1,4-dihydroxybutane-1,4-disulfonate
Also Known As: Succinaldehyde so, Succinaldehyde disodium bisulfite, Succinaldehyde sodium bisulfite, Sodium succinaldehyde bisulfite, Succinaldehyde, bis(sodium bisulfite)
Top 5 of 2 IPC patent classification(s) from the SureChEMBL global patent database.
| Molecular Formula | C4H8Na2O8S2 |
| Molecular Weight | 293.9456 g/mol |
| XLogP | -8.5 |
| Topological Polar Surface Area (TPSA) | 172.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 3 |
| Exact Mass | 293.9456 Da |
| Heavy Atoms | 16 |
| Complexity | 290.0 |
| SMILES | C(CC(O)S(=O)(=O)[O-])C(O)S(=O)(=O)[O-].[Na+].[Na+] |
| InChIKey | SSGMHPVCXKEOSW-UHFFFAOYSA-L |
The XLogP value of -8.5 indicates that 1,4-Butanedisulfonic acid, 1,4-dihydroxy-, sodium salt (1:2) is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 172.0 Ų indicates high polarity, suggesting 1,4-Butanedisulfonic acid, 1,4-dihydroxy-, sodium salt (1:2) may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 1,4-Butanedisulfonic acid, 1,4-dihydroxy-, sodium salt (1:2) has 2 hydrogen bond donor(s) and 8 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of 1,4-Butanedisulfonic acid, 1,4-dihydroxy-, sodium salt (1:2) is 5450-96-4.
The molecular formula of 1,4-Butanedisulfonic acid, 1,4-dihydroxy-, sodium salt (1:2) is C4H8Na2O8S2.
The molecular weight of 1,4-Butanedisulfonic acid, 1,4-dihydroxy-, sodium salt (1:2) is 293.9456 g/mol.
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