TL;DR: Dihydroxy(4-methylphenyl)stibine oxide (CAS 5450-68-0) is a chemical compound with molecular formula C7H9O3Sb and molecular weight 261.95898 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(4-methylphenyl)stibonic acid
Also Known As: p-Toluenestibonic acid, p-Methylphenylstibonic acid, p-Tolylstibonic acid, (4-methylphenyl)stibonic acid, Stibine oxide, dihydroxy-p-tolyl-
Top 5 of 2 IPC patent classification(s) from the SureChEMBL global patent database.
| Molecular Formula | C7H9O3Sb |
| Molecular Weight | 261.95898 g/mol |
| XLogP | -0.44 |
| Topological Polar Surface Area (TPSA) | 57.5 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 261.95898 Da |
| Heavy Atoms | 11 |
| Complexity | 167.0 |
| SMILES | CC1=CC=C(C=C1)[Sb](=O)(O)O |
| InChIKey | DWALBVRONLAVEF-UHFFFAOYSA-L |
The XLogP value of -0.44 indicates that Dihydroxy(4-methylphenyl)stibine oxide is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 57.5 Ų, Dihydroxy(4-methylphenyl)stibine oxide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Dihydroxy(4-methylphenyl)stibine oxide has 2 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of Dihydroxy(4-methylphenyl)stibine oxide is 5450-68-0.
The molecular formula of Dihydroxy(4-methylphenyl)stibine oxide is C7H9O3Sb.
The molecular weight of Dihydroxy(4-methylphenyl)stibine oxide is 261.95898 g/mol.
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