1-(Benzylmethylamino)-3-(alpha,alpha,alpha-Trifluoro-3-Tolyl)Oxy-2-Propanol
[CAS# 5214-61-9]

Identification

• Name: 1-(Benzylmethylamino)-3-(alpha,alpha,alpha-Trifluoro-3-Tolyl)Oxy-2-Propanol
• Synonyms: 1-(Benzyl-Methyl-Amino)-3-[3-(Trifluoromethyl)Phenoxy]Propan-2-Ol; Upjohn Compound 1002; 1-(Benzylmethlamino)-3-(Alpha,Alpha,Alpha-Trifluoro-3-Tolyl)Oxy-2-Propanol
• Molecular Formula: C₁₈H₂₀F₃NO₂
• Molecular Weight: 339.36
• CAS Registry Number: 5214-61-9
• SMILES: C2=C(OCC(O)CN(CC1=CC=CC=C1)C)C=CC=C2C(F)(F)F
• InChI: 1S/C18H20F3NO2/c1-22(11-14-6-3-2-4-7-14)12-16(23)13-24-17-9-5-8-15(10-17)18(19,20)21/h2-10,16,23H,11-13H2,1H3
• InChIKey: KSGFJKSNZLTEDI-UHFFFAOYSA-N

Properties

• Density: 1.217g/cm³ (Cal.)
• Boiling point: 431.201°C at 760 mmHg (Cal.)
• Flash point: 214.583°C (Cal.)