(2S,3R,4E)-2-Amino-4-Icosene-1,3-Diol
[CAS# 6918-49-6]

Identification

• Name: (2S,3R,4E)-2-Amino-4-Icosene-1,3-Diol
• Synonyms: "2S-amino-4E-eicosene-1,3R-diol"; (2S,3R,4E)-2-aminoeicos-4-ene-1,3-diol; (2S,3R,4E)-2-aminoicos-4-ene-1,3-diol
• Molecular Formula: C₂₀H₄₁NO₂
• Molecular Weight: 327.55
• CAS Registry Number: 6918-49-6
• SMILES: O[C@H](/C=C/CCCCCCCCCCCCCCC)[C@@H](N)CO
• InChI: 1S/C20H41NO2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-20(23)19(21)18-22/h16-17,19-20,22-23H,2-15,18,21H2,1H3/b17-16+/t19-,20+/m0/s1
• InChIKey: HTJSZHKGNMXZJN-YIVRLKKSSA-N

Properties

• Density: 0.931g/cm³ (Cal.)
• Boiling point: 471.459°C at 760 mmHg (Cal.)
• Flash point: 238.93°C (Cal.)