Piperidinium, 3-carboxy-1,1-dimethyl-, iodide, ester with choline iodide
TL;DR: Piperidinium, 3-carboxy-1,1-dimethyl-, iodide, ester with choline iodide (CAS 109044-30-6) is a chemical compound with molecular formula C13H28I2N2O2 and molecular weight 498.02402 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-(1,1-dimethylpiperidin-1-ium-3-carbonyl)oxyethyl-trimethylazanium diiodide
Also Known As: 3-Carboxy-1,1-dimethylpiperidinium iodide ester with choline iodide, Piperidinium, 3-carboxy-1,1-dimethyl-, iodide, ester with choline iodide, 2-(1,1-dimethylpiperidin-1-ium-3-carbonyl)oxyethyl-trimethylazanium diiodide, 2-(1,1-dimethylpiperidin-1-ium-3-carbonyl)oxyethyl-trimethylazanium;diiodide, 2-(1,1-DIMETHYL3,4,5,6-TETRAHYDRO-2H-PYRIDINE-3-CARBONYL)OXYETHYL-TRIM ETHYL-AZANIUM DIIODIDE
Technical Specifications
| Molecular Formula | C13H28I2N2O2 |
| Molecular Weight | 498.02402 g/mol |
| XLogP | -5.2698 |
| Topological Polar Surface Area (TPSA) | 26.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 498.02402 Da |
| Heavy Atoms | 19 |
| Complexity | 269.0 |
| SMILES | C[N+]1(CCCC(C1)C(=O)OCC[N+](C)(C)C)C.[I-].[I-] |
| InChIKey | SPTSCJIEXOMGQM-UHFFFAOYSA-L |
Chemical Property Profile of Piperidinium, 3-carboxy-1,1-dimethyl-, iodide, ester with choline iodide
Property Insights of Piperidinium, 3-carboxy-1,1-dimethyl-, iodide, ester with choline iodide
The XLogP value of -5.2698 indicates that Piperidinium, 3-carboxy-1,1-dimethyl-, 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 26.3 Ų, Piperidinium, 3-carboxy-1,1-dimethyl-, iodide, ester with choline iodide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Piperidinium, 3-carboxy-1,1-dimethyl-, 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 Piperidinium, 3-carboxy-1,1-dimethyl-, iodide, ester with choline iodide?
The CAS number of Piperidinium, 3-carboxy-1,1-dimethyl-, iodide, ester with choline iodide is 109044-30-6.
What is the molecular formula of Piperidinium, 3-carboxy-1,1-dimethyl-, iodide, ester with choline iodide?
The molecular formula of Piperidinium, 3-carboxy-1,1-dimethyl-, iodide, ester with choline iodide is C13H28I2N2O2.
What is the molecular weight of Piperidinium, 3-carboxy-1,1-dimethyl-, iodide, ester with choline iodide?
The molecular weight of Piperidinium, 3-carboxy-1,1-dimethyl-, iodide, ester with choline iodide is 498.02402 g/mol.
Where can I buy Piperidinium, 3-carboxy-1,1-dimethyl-, iodide, ester with choline iodide?
You can request a quote for Piperidinium, 3-carboxy-1,1-dimethyl-, iodide, ester with choline iodide directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Piperidinium, 3-carboxy-1,1-dimethyl-, iodide, ester with choline iodide?
Yes, CoreyChem provides custom synthesis services for Piperidinium, 3-carboxy-1,1-dimethyl-, iodide, ester with choline iodide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.