TL;DR: (3-Aminopropyl)(n-butyl)phosphinic acid (CAS 145537-81-1) is a chemical compound with molecular formula CCCCP(=O)(CCCN)O and molecular weight 179.10751 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
3-aminopropyl(butyl)phosphinic acid
Also Known As: Cgp 36742, 3-aminopropyl(butyl)phosphinic acid, SGS742, (3-Aminopropyl)(n-butyl)phosphinic acid, SGS 742
Top 5 of 4 IPC patent classification(s) from the SureChEMBL global patent database.
| Molecular Formula | CCCCP(=O)(CCCN)O |
| Molecular Weight | 179.10751 g/mol |
| XLogP | -2.7 |
| Topological Polar Surface Area (TPSA) | 63.3 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 6 |
| Exact Mass | 179.10751 Da |
| Heavy Atoms | 11 |
| Complexity | 138.0 |
| SMILES | CCCCP(=O)(CCCN)O |
| InChIKey | ONNMDRQRSGKZCN-UHFFFAOYSA-N |
The XLogP value of -2.7 indicates that (3-Aminopropyl)(n-butyl)phosphinic acid is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 63.3 Ų falls within the moderate polarity range, balancing permeability and solubility for (3-Aminopropyl)(n-butyl)phosphinic acid. Following Lipinski's Rule of Five, (3-Aminopropyl)(n-butyl)phosphinic acid 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 (3-Aminopropyl)(n-butyl)phosphinic acid is 145537-81-1.
The molecular formula of (3-Aminopropyl)(n-butyl)phosphinic acid is CCCCP(=O)(CCCN)O.
The molecular weight of (3-Aminopropyl)(n-butyl)phosphinic acid is 179.10751 g/mol.
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