3-Octadecanamido-2-ethoxypropylphosphocholine
TL;DR: 3-Octadecanamido-2-ethoxypropylphosphocholine (CAS 112989-02-3) is a chemical compound with molecular formula C28H59N2O6P and molecular weight 550.4111 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
[2-ethoxy-3-(octadecanoylamino)propyl] 2-(trimethylazaniumyl)ethyl phosphate
Also Known As: 3-Oeppc, Phosphoether lipid analog, rac-3-Octadecanamido-2-ethoxypropan-1-ol Phosphocholine, rac-2-Ethoxy-3-octadecanamido-1-propylphosphocholine, AM-18-OEt
Technical Specifications
| Molecular Formula | C28H59N2O6P |
| Molecular Weight | 550.4111 g/mol |
| XLogP | 7.0 |
| Topological Polar Surface Area (TPSA) | 96.9 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 27 |
| Exact Mass | 550.4111 Da |
| Heavy Atoms | 37 |
| Complexity | 577.0 |
| SMILES | CCCCCCCCCCCCCCCCCC(=O)NCC(COP(=O)([O-])OCC[N+](C)(C)C)OCC |
| InChIKey | QUVZKDZYEOYGKV-UHFFFAOYSA-N |
Chemical Property Profile of 3-Octadecanamido-2-ethoxypropylphosphocholine
Property Insights of 3-Octadecanamido-2-ethoxypropylphosphocholine
The XLogP value of 7.0 indicates that 3-Octadecanamido-2-ethoxypropylphosphocholine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 96.9 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-Octadecanamido-2-ethoxypropylphosphocholine. Following Lipinski's Rule of Five, 3-Octadecanamido-2-ethoxypropylphosphocholine has 1 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
What is the CAS number of 3-Octadecanamido-2-ethoxypropylphosphocholine?
The CAS number of 3-Octadecanamido-2-ethoxypropylphosphocholine is 112989-02-3.
What is the molecular formula of 3-Octadecanamido-2-ethoxypropylphosphocholine?
The molecular formula of 3-Octadecanamido-2-ethoxypropylphosphocholine is C28H59N2O6P.
What is the molecular weight of 3-Octadecanamido-2-ethoxypropylphosphocholine?
The molecular weight of 3-Octadecanamido-2-ethoxypropylphosphocholine is 550.4111 g/mol.
Where can I buy 3-Octadecanamido-2-ethoxypropylphosphocholine?
You can request a quote for 3-Octadecanamido-2-ethoxypropylphosphocholine directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 3-Octadecanamido-2-ethoxypropylphosphocholine?
Yes, CoreyChem provides custom synthesis services for 3-Octadecanamido-2-ethoxypropylphosphocholine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.