TL;DR: N-ethyl-1,2-dioleoylphosphatidylethanolamine (CAS 121521-33-3) is a chemical compound with molecular formula C43H82NO8P and molecular weight 771.5778 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
[3-[2-(ethylamino)ethoxy-hydroxyphosphoryl]oxy-2-[(E)-octadec-9-enoyl]oxypropyl] (E)-octadec-9-enoate
Also Known As: N-Ethyl-dope, N-Ethyl-1,2-dioleoylphosphatidylethanolamine, N-Ethyl-1,2-dioleoyl-sn-glycero-3-phosphoethanolamine, [3-[2-(ethylamino)ethoxy-hydroxyphosphoryl]oxy-2-[(E)-octadec-9-enoyl]oxypropyl] (E)-octadec-9-enoate, 9-Octadecenoic acid (Z)-, 1-(3-hydroxy-2,4-dioxa-7-aza-3-phosphanon-1-yl)-1,2-ethanediyl ester, P-oxide
| Molecular Formula | C43H82NO8P |
| Molecular Weight | 771.5778 g/mol |
| XLogP | 11.4 |
| Topological Polar Surface Area (TPSA) | 120.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 43 |
| Exact Mass | 771.5778 Da |
| Heavy Atoms | 53 |
| Complexity | 928.0 |
| SMILES | CCCCCCCC/C=C/CCCCCCCC(=O)OCC(COP(=O)(O)OCCNCC)OC(=O)CCCCCCC/C=C/CCCCCCCC |
| InChIKey | DZYSBRAFLSOLER-FLFKKZLDSA-N |
The XLogP value of 11.4 indicates that N-ethyl-1,2-dioleoylphosphatidylethanolamine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 120.0 Ų falls within the moderate polarity range, balancing permeability and solubility for N-ethyl-1,2-dioleoylphosphatidylethanolamine. Following Lipinski's Rule of Five, N-ethyl-1,2-dioleoylphosphatidylethanolamine has 2 hydrogen bond donor(s) and 9 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
The CAS number of N-ethyl-1,2-dioleoylphosphatidylethanolamine is 121521-33-3.
The molecular formula of N-ethyl-1,2-dioleoylphosphatidylethanolamine is C43H82NO8P.
The molecular weight of N-ethyl-1,2-dioleoylphosphatidylethanolamine is 771.5778 g/mol.
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