TL;DR: 1-Propanaminium, 2-hydroxy-N,N,N-trimethyl-, formate (1:1) (CAS 62314-25-4) is a chemical compound with molecular formula C7H17NO3 and molecular weight 163.12085 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-hydroxypropyl(trimethyl)azanium formate
Also Known As: beta-Methylcholine, (2-Hydroxypropyl)trimethylammonium formate, 2-HYDROXYPROPYLTRIMETHYLAMMONIUMFORMATE, 2-hydroxypropyl(trimethyl)azanium;formate, 2-hydroxypropyl(trimethyl)azanium,formate
Top 5 of 6 IPC patent classification(s) from the SureChEMBL global patent database.
| Molecular Formula | C7H17NO3 |
| Molecular Weight | 163.12085 g/mol |
| XLogP | -1.56 |
| Topological Polar Surface Area (TPSA) | 60.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 163.12085 Da |
| Heavy Atoms | 11 |
| Complexity | 72.0 |
| SMILES | CC(C[N+](C)(C)C)O.C(=O)[O-] |
| InChIKey | OTOLFQXGRCJFQN-UHFFFAOYSA-M |
The XLogP value of -1.56 indicates that 1-Propanaminium, 2-hydroxy-N,N,N-trimethyl-, formate (1:1) is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 60.4 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-Propanaminium, 2-hydroxy-N,N,N-trimethyl-, formate (1:1). Following Lipinski's Rule of Five, 1-Propanaminium, 2-hydroxy-N,N,N-trimethyl-, formate (1:1) has 1 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 1-Propanaminium, 2-hydroxy-N,N,N-trimethyl-, formate (1:1) is 62314-25-4.
The molecular formula of 1-Propanaminium, 2-hydroxy-N,N,N-trimethyl-, formate (1:1) is C7H17NO3.
The molecular weight of 1-Propanaminium, 2-hydroxy-N,N,N-trimethyl-, formate (1:1) is 163.12085 g/mol.
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