Pyridinium, 3-carboxy-1-methyl-, iodide, ester with choline iodide
TL;DR: Pyridinium, 3-carboxy-1-methyl-, iodide, ester with choline iodide (CAS 108847-17-2) is a chemical compound with molecular formula C12H20I2N2O2 and molecular weight 477.96143 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
trimethyl-[2-(1-methylpyridin-1-ium-3-carbonyl)oxyethyl]azanium diiodide
Also Known As: 3-Carboxy-1-methylpyridinium iodide ester with choline iodide, Pyridinium, 3-carboxy-1-methyl-, iodide, ester with choline iodide, trimethyl-[2-(1-methylpyridin-1-ium-3-carbonyl)oxyethyl]azanium;diiodide, trimethyl-[2-(1-methylpyridine-5-carbonyl)oxyethyl]azanium diiodide, Pyridinium,3-carboxy-1-methyl-,iodide,ester with choline iodide
Technical Specifications
| Molecular Formula | C12H20I2N2O2 |
| Molecular Weight | 477.96143 g/mol |
| XLogP | -5.6179 |
| Topological Polar Surface Area (TPSA) | 30.2 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 477.96143 Da |
| Heavy Atoms | 18 |
| Complexity | 236.0 |
| SMILES | C[N+]1=CC=CC(=C1)C(=O)OCC[N+](C)(C)C.[I-].[I-] |
| InChIKey | YUYNXVIZIZJRRU-UHFFFAOYSA-L |
Chemical Property Profile of Pyridinium, 3-carboxy-1-methyl-, iodide, ester with choline iodide
Property Insights of Pyridinium, 3-carboxy-1-methyl-, iodide, ester with choline iodide
The XLogP value of -5.6179 indicates that Pyridinium, 3-carboxy-1-methyl-, iodide, ester with choline iodide is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 30.2 Ų, Pyridinium, 3-carboxy-1-methyl-, iodide, ester with choline iodide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Pyridinium, 3-carboxy-1-methyl-, iodide, ester with choline iodide has 0 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of Pyridinium, 3-carboxy-1-methyl-, iodide, ester with choline iodide?
The CAS number of Pyridinium, 3-carboxy-1-methyl-, iodide, ester with choline iodide is 108847-17-2.
What is the molecular formula of Pyridinium, 3-carboxy-1-methyl-, iodide, ester with choline iodide?
The molecular formula of Pyridinium, 3-carboxy-1-methyl-, iodide, ester with choline iodide is C12H20I2N2O2.
What is the molecular weight of Pyridinium, 3-carboxy-1-methyl-, iodide, ester with choline iodide?
The molecular weight of Pyridinium, 3-carboxy-1-methyl-, iodide, ester with choline iodide is 477.96143 g/mol.
Where can I buy Pyridinium, 3-carboxy-1-methyl-, iodide, ester with choline iodide?
You can request a quote for Pyridinium, 3-carboxy-1-methyl-, iodide, ester with choline iodide directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Pyridinium, 3-carboxy-1-methyl-, iodide, ester with choline iodide?
Yes, CoreyChem provides custom synthesis services for Pyridinium, 3-carboxy-1-methyl-, iodide, ester with choline iodide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.