TL;DR: p-Methoxybenzeneselenol, sodium salt (CAS 104901-59-9) is a chemical compound with molecular formula C7H7NaOSe and molecular weight 209.95598 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
sodium 4-methoxybenzeneselenolate
Also Known As: Hemiacetylcarnitinium, p-Methoxybenzeneselenol, sodium salt, sodium 4-methoxybenzeneselenolate, Sodium 4-methoxybenzene-1-selenolate, CCRIS 5875
Top 5 of 1 IPC patent classification(s) from the SureChEMBL global patent database.
| Molecular Formula | C7H7NaOSe |
| Molecular Weight | 209.95598 g/mol |
| XLogP | -2.507 |
| Topological Polar Surface Area (TPSA) | 9.2 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 209.95598 Da |
| Heavy Atoms | 10 |
| Complexity | 77.0 |
| SMILES | COC1=CC=C(C=C1)[Se-].[Na+] |
| InChIKey | FPTQLNDVNKCVRQ-UHFFFAOYSA-M |
The XLogP value of -2.507 indicates that p-Methoxybenzeneselenol, sodium salt is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 9.2 Ų, p-Methoxybenzeneselenol, sodium salt exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, p-Methoxybenzeneselenol, sodium salt has 0 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of p-Methoxybenzeneselenol, sodium salt is 104901-59-9.
The molecular formula of p-Methoxybenzeneselenol, sodium salt is C7H7NaOSe.
The molecular weight of p-Methoxybenzeneselenol, sodium salt is 209.95598 g/mol.
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