Sodium (Z)-1-(Octadec-9-Enyl)-5-Oxopyrrolidine-3-Carboxylate
[CAS# 94108-42-6]

Identification

• Name: Sodium (Z)-1-(Octadec-9-Enyl)-5-Oxopyrrolidine-3-Carboxylate
• Synonyms: Sodium 1-[(E)-Octadec-9-Enyl]-5-Oxo-Pyrrolidine-3-Carboxylate; Sodium 1-[(E)-Octadec-9-Enyl]-5-Oxo-3-Pyrrolidinecarboxylate; Sodium 5-Keto-1-[(E)-Octadec-9-Enyl]Pyrrolidine-3-Carboxylate
• Molecular Formula: C₂₃H₄₀NNaO₃
• Molecular Weight: 401.56
• CAS Registry Number: 94108-42-6
• EINECS: 302-382-7
• SMILES: C(N1C(=O)CC(C1)C([O-])=O)CCCCCCC\C=C\CCCCCCCC.[Na+]
• InChI: 1S/C23H41NO3.Na/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-24-20-21(23(26)27)19-22(24)25;/h9-10,21H,2-8,11-20H2,1H3,(H,26,27);/q;+1/p-1/b10-9+
• InChIKey: HYWZHNDAUMQTKO-RRABGKBLSA-M

Properties

• Boiling point: 546.1°C at 760 mmHg (Cal.)
• Flash point: 284.1°C (Cal.)