Choline, iodide, 1-hydroxy-alpha-phenylcyclopentaneacetate
TL;DR: Choline, iodide, 1-hydroxy-alpha-phenylcyclopentaneacetate (CAS 110180-50-2) is a chemical compound with molecular formula C18H28INO3 and molecular weight 433.1114 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-[2-(1-hydroxycyclopentyl)-2-phenylacetyl]oxyethyl-trimethylazanium iodide
Also Known As: Choline, iodide, 1-hydroxy-alpha-phenylcyclopentaneacetate, 2-[2-(1-hydroxycyclopentyl)-2-phenylacetyl]oxyethyl-trimethy, 2-[2-(1-hydroxycyclopentyl)-2-phenylacetyl]oxyethyl-trimethylazanium iodide, 2-{[(1-Hydroxycyclopentyl)(phenyl)acetyl]oxy}-N,N,N-trimethylethan-1-aminium iodide
Technical Specifications
| Molecular Formula | C18H28INO3 |
| Molecular Weight | 433.1114 g/mol |
| XLogP | -0.6713 |
| Topological Polar Surface Area (TPSA) | 46.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 7 |
| Exact Mass | 433.1114 Da |
| Heavy Atoms | 23 |
| Complexity | 363.0 |
| SMILES | C[N+](C)(C)CCOC(=O)C(C1=CC=CC=C1)C2(CCCC2)O.[I-] |
| InChIKey | XTYPKXUALIKLCI-UHFFFAOYSA-M |
Chemical Property Profile of Choline, iodide, 1-hydroxy-alpha-phenylcyclopentaneacetate
Property Insights of Choline, iodide, 1-hydroxy-alpha-phenylcyclopentaneacetate
The XLogP value of -0.6713 indicates that Choline, iodide, 1-hydroxy-alpha-phenylcyclopentaneacetate is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 46.5 Ų, Choline, iodide, 1-hydroxy-alpha-phenylcyclopentaneacetate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Choline, iodide, 1-hydroxy-alpha-phenylcyclopentaneacetate has 1 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 Choline, iodide, 1-hydroxy-alpha-phenylcyclopentaneacetate?
The CAS number of Choline, iodide, 1-hydroxy-alpha-phenylcyclopentaneacetate is 110180-50-2.
What is the molecular formula of Choline, iodide, 1-hydroxy-alpha-phenylcyclopentaneacetate?
The molecular formula of Choline, iodide, 1-hydroxy-alpha-phenylcyclopentaneacetate is C18H28INO3.
What is the molecular weight of Choline, iodide, 1-hydroxy-alpha-phenylcyclopentaneacetate?
The molecular weight of Choline, iodide, 1-hydroxy-alpha-phenylcyclopentaneacetate is 433.1114 g/mol.
Where can I buy Choline, iodide, 1-hydroxy-alpha-phenylcyclopentaneacetate?
You can request a quote for Choline, iodide, 1-hydroxy-alpha-phenylcyclopentaneacetate directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Choline, iodide, 1-hydroxy-alpha-phenylcyclopentaneacetate?
Yes, CoreyChem provides custom synthesis services for Choline, iodide, 1-hydroxy-alpha-phenylcyclopentaneacetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.