2-Aminoethyl-[(Z)-Octadec-9-Enoyl]Ammonium Phosphate
[CAS# 100021-80-5]

Identification

• Name: 2-Aminoethyl-[(Z)-Octadec-9-Enoyl]Ammonium Phosphate
• Synonyms: (2-aminoethyl)oleoylammonium dihydrogen phosphate
• Molecular Formula: C₂₀H₄₁N₂O₅P
• Molecular Weight: 420.52
• CAS Registry Number: 100021-80-5
• EINECS: 309-106-4
• SMILES: O=C(CCCCCCC/C=C\CCCCCCCC)[NH2+]CCN.[O-]P([O-])([O-])=O
• InChI: 1S/C20H40N2O.H3O4P/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-20(23)22-19-18-21;1-5(2,3)4/h9-10H,2-8,11-19,21H2,1H3,(H,22,23);(H3,1,2,3,4)/p-2/b10-9-
• InChIKey: UMIWJUPRWKLHSD-KVVVOXFISA-L

Properties

• Boiling point: 654.4°C at 760 mmHg (Cal.)
• Flash point: 349.6°C (Cal.)
• Refractive index: (Cal.)