Pellotine
[CAS# 83-14-7]

Identification

• Name: Pellotine
• Synonyms: (-)-Pellotine; C09604; Pellotine
• Molecular Formula: C₁₃H₁₉NO₃
• Molecular Weight: 237.30
• CAS Registry Number: 83-14-7
• SMILES: [C@@H]1(N(CCC2=CC(=C(OC)C(=C12)O)OC)C)C
• InChI: 1S/C13H19NO3/c1-8-11-9(5-6-14(8)2)7-10(16-3)13(17-4)12(11)15/h7-8,15H,5-6H2,1-4H3/t8-/m1/s1
• InChIKey: NKHMWHLJHODBEP-MRVPVSSYSA-N

Properties

• Density: 1.11g/cm³ (Cal.)
• Boiling point: 302.749°C at 760 mmHg (Cal.)
• Flash point: 136.898°C (Cal.)