胆碱碘化物α-苯基环己烷乙酸酯
TL;DR: 胆碱碘化物α-苯基环己烷乙酸酯 (CAS 2424-74-0) is a chemical compound with molecular formula C19H30INO2 and molecular weight 431.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
胆碱碘化物α-苯基环己烷乙酸酯
2-(2-cyclohexyl-2-phenylacetyl)oxyethyl-trimethylazanium iodide
Also Known As: P 46K, Choline, iodide, alpha-phenylcyclohexaneacetate, 2-(2-cyclohexyl-2-phenylacetyl)oxyethyl-trimethylazanium iodide, 2-(2-cyclohexyl-2-phenylacetyl)oxyethyl-trimethylazanium,iod, 2-{[Cyclohexyl(phenyl)acetyl]oxy}-N,N,N-trimethylethan-1-aminium iodide
| Molecular Formula | C19H30INO2 |
|---|---|
| Molecular Weight | 431.13 g/mol |
| LogP | 0.6039 |
| Topological Polar Surface Area | 26.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 7 |
| Exact Mass | 431.13214 |
| Heavy Atoms | 23 |
| Complexity | 336.0 |
Chemical Identifiers
| CAS Number | 2424-74-0 |
|---|---|
| SMILES | C[N+](C)(C)CCOC(=O)C(C1CCCCC1)C2=CC=CC=C2.[I-] |
| InChIKey | YXRRPFIYEBUVGB-UHFFFAOYSA-M |
Product Overview
胆碱碘化物α-苯基环己烷乙酸酯 (CAS 2424-74-0), with molecular formula C19H30INO2 and molecular weight 431.13 g/mol. IUPAC: 2-(2-cyclohexyl-2-phenylacetyl)oxyethyl-trimethylazanium iodide.
Chemical Property Profile of 胆碱碘化物α-苯基环己烷乙酸酯
Property Insights of 胆碱碘化物α-苯基环己烷乙酸酯
The XLogP value of 0.6039 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 胆碱碘化物α-苯基环己烷乙酸酯. With a topological polar surface area (TPSA) of 26.3 Ų, 胆碱碘化物α-苯基环己烷乙酸酯 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 胆碱碘化物α-苯基环己烷乙酸酯 has 0 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 胆碱碘化物α-苯基环己烷乙酸酯?
The CAS number of 胆碱碘化物α-苯基环己烷乙酸酯 is 2424-74-0.
What is the molecular formula of 胆碱碘化物α-苯基环己烷乙酸酯?
The molecular formula of 胆碱碘化物α-苯基环己烷乙酸酯 is C19H30INO2.
What is the molecular weight of 胆碱碘化物α-苯基环己烷乙酸酯?
The molecular weight of 胆碱碘化物α-苯基环己烷乙酸酯 is 431.13 g/mol.
Where can I buy 胆碱碘化物α-苯基环己烷乙酸酯?
You can request a quote for 胆碱碘化物α-苯基环己烷乙酸酯 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 胆碱碘化物α-苯基环己烷乙酸酯?
Yes, KEHONG BIO provides custom synthesis services for 胆碱碘化物α-苯基环己烷乙酸酯 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.