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2-[Docos-13-enoxy(hydroxy)phosphoryl]oxyethyl-trimethylazanium
TL;DR: 2-[Docos-13-enoxy(hydroxy)phosphoryl]oxyethyl-trimethylazanium (CAS 143317-74-2) is a chemical compound with molecular formula C27H57NO4P+ and molecular weight 490.40 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[docos-13-enoxy(hydroxy)phosphoryl]oxyethyl-trimethylazanium
Also Known As: Erucylphosphocholine, ErPC, 2-[docos-13-enoxy(hydroxy)phosphoryl]oxyethyl-trimethylazanium, Ethanaminium,2-[[[(13Z)-13-docosen-1-yloxy]hydroxyphosphinyl]oxy]-N,N,N-trimethyl-, innersalt, EPC
| Molecular Formula | C27H57NO4P+ |
|---|---|
| Molecular Weight | 490.40 g/mol |
| LogP | 9.1 |
| Topological Polar Surface Area | 55.8 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 25 |
| Exact Mass | 490.40253 |
| Heavy Atoms | 33 |
| Complexity | 491.0 |
Chemical Identifiers
| CAS Number | 143317-74-2 |
|---|---|
| SMILES | CCCCCCCCC=CCCCCCCCCCCCCOP(=O)(O)OCC[N+](C)(C)C |
| InChIKey | KCRSJPCXPQESIU-UHFFFAOYSA-O |
Patent-Derived Application Labels
Derived from 7 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2-[Docos-13-enoxy(hydroxy)phosphoryl]oxyethyl-trimethylazanium (CAS 143317-74-2), with molecular formula C27H57NO4P+ and molecular weight 490.40 g/mol. IUPAC: 2-[docos-13-enoxy(hydroxy)phosphoryl]oxyethyl-trimethylazanium.
Chemical Property Profile of 2-[Docos-13-enoxy(hydroxy)phosphoryl]oxyethyl-trimethylazanium
Property Insights of 2-[Docos-13-enoxy(hydroxy)phosphoryl]oxyethyl-trimethylazanium
The XLogP value of 9.1 indicates that 2-[Docos-13-enoxy(hydroxy)phosphoryl]oxyethyl-trimethylazanium is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 55.8 Ų, 2-[Docos-13-enoxy(hydroxy)phosphoryl]oxyethyl-trimethylazanium exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-[Docos-13-enoxy(hydroxy)phosphoryl]oxyethyl-trimethylazanium has 1 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 2-[Docos-13-enoxy(hydroxy)phosphoryl]oxyethyl-trimethylazanium?
The CAS number of 2-[Docos-13-enoxy(hydroxy)phosphoryl]oxyethyl-trimethylazanium is 143317-74-2.
What is the molecular formula of 2-[Docos-13-enoxy(hydroxy)phosphoryl]oxyethyl-trimethylazanium?
The molecular formula of 2-[Docos-13-enoxy(hydroxy)phosphoryl]oxyethyl-trimethylazanium is C27H57NO4P+.
What is the molecular weight of 2-[Docos-13-enoxy(hydroxy)phosphoryl]oxyethyl-trimethylazanium?
The molecular weight of 2-[Docos-13-enoxy(hydroxy)phosphoryl]oxyethyl-trimethylazanium is 490.40 g/mol.
Where can I buy 2-[Docos-13-enoxy(hydroxy)phosphoryl]oxyethyl-trimethylazanium?
You can request a quote for 2-[Docos-13-enoxy(hydroxy)phosphoryl]oxyethyl-trimethylazanium directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-[Docos-13-enoxy(hydroxy)phosphoryl]oxyethyl-trimethylazanium?
Yes, KEHONG BIO provides custom synthesis services for 2-[Docos-13-enoxy(hydroxy)phosphoryl]oxyethyl-trimethylazanium and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.