TL;DR: Choline, chloride, formate (CAS 63938-99-8) is a chemical compound with molecular formula C6H14ClNO2 and molecular weight 167.0713 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-formyloxyethyl(trimethyl)azanium chloride
Also Known As: Choline, chloride, formate, CHOLINE CHLORIDE FORMATE, 2-(Formyloxy)-N,N,N-trimethylethanaminium chloride, 2-formyloxyethyl(trimethyl)azanium chloride, (2-Ethylcarbamoyloxy-ethyl)-trimethyl-ammonium
Top 5 of 5 IPC patent classification(s) from the SureChEMBL global patent database.
| Molecular Formula | C6H14ClNO2 |
| Molecular Weight | 167.0713 g/mol |
| XLogP | -3.13 |
| Topological Polar Surface Area (TPSA) | 26.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 167.0713 Da |
| Heavy Atoms | 10 |
| Complexity | 85.0 |
| SMILES | C[N+](C)(C)CCOC=O.[Cl-] |
| InChIKey | PSUJIYROJDUUNF-UHFFFAOYSA-M |
The XLogP value of -3.13 indicates that Choline, chloride, formate is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 26.3 Ų, Choline, chloride, formate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Choline, chloride, formate has 0 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 Choline, chloride, formate is 63938-99-8.
The molecular formula of Choline, chloride, formate is C6H14ClNO2.
The molecular weight of Choline, chloride, formate is 167.0713 g/mol.
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