N-[(9Z)-9-Octadecen-1-yl]-1,3-propanediaminium bis(hydroxyacetate)
[CAS# 93859-51-9]

Identification

• Name: N-[(9Z)-9-Octadecen-1-yl]-1,3-propanediaminium bis(hydroxyacetate)
• Synonyms: (Z)-N-octadec-9-enylpropane-1,3-diyldiammonium bis(hydroxyacetate)
• Molecular Formula: C₂₅H₅₂N₂O₆
• Molecular Weight: 476.69
• CAS Registry Number: 93859-51-9
• EINECS: 299-390-5
• SMILES: O=C([O-])CO.[O-]C(=O)CO.CCCCCCCC\C=C/CCCCCCCC[NH2+]CCC[NH3+]
• InChI: 1S/C21H44N2.2C2H4O3/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-20-23-21-18-19-22;2*3-1-2(4)5/h9-10,23H,2-8,11-22H2,1H3;2*3H,1H2,(H,4,5)/b10-9-
• InChIKey: WHNDJHDROKNHQP-XXAVUKJNSA-N

Properties

• Boiling point: 676.3°C at 760 mmHg (Cal.)
• Flash point: 362.8°C (Cal.)