12-Ketooleic Acid
[CAS# 5455-97-0]

Identification

• Name: 12-Ketooleic Acid
• Synonyms: (Z)-12-Ketooctadec-9-Enoic Acid; 9-Octadecenoic Acid, 12-Oxo-, (E)-; Elaidic Acid, 12-Oxo-
• Molecular Formula: C₁₈H₃₂O₃
• Molecular Weight: 296.45
• CAS Registry Number: 5455-97-0
• SMILES: C(C(=O)CCCCCC)\C=C/CCCCCCCC(=O)O
• InChI: 1S/C18H32O3/c1-2-3-4-11-14-17(19)15-12-9-7-5-6-8-10-13-16-18(20)21/h9,12H,2-8,10-11,13-16H2,1H3,(H,20,21)/b12-9-
• InChIKey: QHEOVCWNVASAFS-XFXZXTDPSA-N

Properties

• Density: 0.953g/cm³ (Cal.)
• Boiling point: 409.917°C at 760 mmHg (Cal.)
• Flash point: 215.865°C (Cal.)