Tofetridine
[CAS# 40173-75-9]

Identification

• Name: Tofetridine
• Synonyms: Tofetridine; Tofetridine [Inn]
• Molecular Formula: C₁₅H₂₁NO
• Molecular Weight: 231.34
• CAS Registry Number: 40173-75-9
• SMILES: C1=C(OC)C=CC2=C1C3(C(NC2)CCCC3)C
• InChI: 1S/C15H21NO/c1-15-8-4-3-5-14(15)16-10-11-6-7-12(17-2)9-13(11)15/h6-7,9,14,16H,3-5,8,10H2,1-2H3
• InChIKey: IQYAWBKZKZRPEQ-UHFFFAOYSA-N

Properties

• Density: 1.037g/cm³ (Cal.)
• Boiling point: 346.639°C at 760 mmHg (Cal.)
• Flash point: 144.132°C (Cal.)