[3-[2-(ethylamino)ethoxy-hydroxyphosphoryl]oxy-2-[(E)-octadec-9-enoyl]oxypropyl] (E)-octadec-9-enoate

Base Information

• Chemical Name: [3-[2-(ethylamino)ethoxy-hydroxyphosphoryl]oxy-2-[(E)-octadec-9-enoyl]oxypropyl] (E)-octadec-9-enoate
• CAS No.: 121521-33-3
• Molecular Formula: C43H82 N O8 P
• Molecular Weight: 772.09
• Mol file: 121521-33-3.mol

Synonyms:N-ethyl-1,2-dioleoyl-sn-glycero-3-phosphoethanolamine;N-ethyl-1,2-dioleoylphosphatidylethanolamine;N-ethyl-DOPE

Chemical Property of [3-[2-(ethylamino)ethoxy-hydroxyphosphoryl]oxy-2-[(E)-octadec-9-enoyl]oxypropyl] (E)-octadec-9-enoate

Chemical Property:

• Vapor Pressure: 6.48E-26mmHg at 25°C
• Boiling Point: 769.2°Cat760mmHg
• PKA: 1.33±0.50(Predicted)
• Flash Point: 419°C
• PSA: 130.20000
• Density: 0.994g/cm³
• LogP: 12.65040
• XLogP3: 11.4
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 9
• Rotatable Bond Count: 43
• Exact Mass: 771.57780557
• Heavy Atom Count: 53
• Complexity: 928

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCCCCCCCC=CCCCCCCCC(=O)OCC(COP(=O)(O)OCCNCC)OC(=O)CCCCCCCC=CCCCCCCCC
• Isomeric SMILES: CCCCCCCC/C=C/CCCCCCCC(=O)OCC(COP(=O)(O)OCCNCC)OC(=O)CCCCCCC/C=C/CCCCCCCC