Conocandin
[CAS# 61371-61-7]

Identification

• Name: Conocandin
• Synonyms: 2-[(2S,3S)-3-[(E)-6-Methyldodec-5-Enyl]-2-Oxiranyl]Prop-2-Enoic Acid; 2-[(2S,3S)-3-[(E)-6-Methyldodec-5-Enyl]Oxiran-2-Yl]Acrylic Acid; 2-Methylidene-10-Methyl-Trans-3,4-Epoxy-9-Hexadecenoic Acid
• Molecular Formula: C₁₈H₃₀O₃
• Molecular Weight: 294.43
• CAS Registry Number: 61371-61-7
• SMILES: [C@H]1(O[C@H]1CCCC\C=C(\CCCCCC)C)C(C(=O)O)=C
• InChI: 1S/C18H30O3/c1-4-5-6-8-11-14(2)12-9-7-10-13-16-17(21-16)15(3)18(19)20/h12,16-17H,3-11,13H2,1-2H3,(H,19,20)/b14-12+/t16-,17-/m0/s1
• InChIKey: WSCIWZRMZZZKRD-KIXISSKZSA-N

Properties

• Density: 0.991g/cm³ (Cal.)
• Boiling point: 437.405°C at 760 mmHg (Cal.)
• Flash point: 149.373°C (Cal.)