Palmitoylcholine
TL;DR: Palmitoylcholine (CAS 13100-90-8) is a chemical compound with molecular formula C21H44NO2+ and molecular weight 342.34 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-hexadecanoyloxyethyl(trimethyl)azanium
Also Known As: Palmitoylcholine, Ichthycrinotoxin, O-Palmitoylcholine, Palmitylcholin, choline palmitate
| Molecular Formula | C21H44NO2+ |
|---|---|
| Molecular Weight | 342.34 g/mol |
| LogP | 7.5 |
| Topological Polar Surface Area | 26.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 18 |
| Exact Mass | 342.33722 |
| Heavy Atoms | 24 |
| Complexity | 284.0 |
Chemical Identifiers
| CAS Number | 13100-90-8 |
|---|---|
| SMILES | CCCCCCCCCCCCCCCC(=O)OCC[N+](C)(C)C |
| InChIKey | ODYPFMHOOQOHEF-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 7 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Palmitoylcholine (CAS 13100-90-8), with molecular formula C21H44NO2+ and molecular weight 342.34 g/mol. IUPAC: 2-hexadecanoyloxyethyl(trimethyl)azanium.
Chemical Property Profile of Palmitoylcholine
Property Insights of Palmitoylcholine
The XLogP value of 7.5 indicates that Palmitoylcholine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 26.3 Ų, Palmitoylcholine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Palmitoylcholine has 0 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Palmitoylcholine?
The CAS number of Palmitoylcholine is 13100-90-8.
What is the molecular formula of Palmitoylcholine?
The molecular formula of Palmitoylcholine is C21H44NO2+.
What is the molecular weight of Palmitoylcholine?
The molecular weight of Palmitoylcholine is 342.34 g/mol.
Where can I buy Palmitoylcholine?
You can request a quote for Palmitoylcholine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Palmitoylcholine?
Yes, KEHONG BIO provides custom synthesis services for Palmitoylcholine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.