4-[(1S)-3-(Methylamino)-1-(2-thienyl)propoxy]-1-naphthol
[CAS# 662149-13-5]

Identification

• Name: 4-[(1S)-3-(Methylamino)-1-(2-thienyl)propoxy]-1-naphthol
• Synonyms: 4-((S)-3-Methylamino-1-thiophen-2-yl-propoxy)-naphthalen-1-ol; 4-Hydroxy Duloxetine
• Molecular Formula: C₁₈H₁₉NO₂S
• Molecular Weight: 313.41
• CAS Registry Number: 662149-13-5
• SMILES: CNCC[C@@H](C1=CC=CS1)OC2=CC=C(C3=CC=CC=C32)O
• InChI: 1S/C18H19NO2S/c1-19-11-10-17(18-7-4-12-22-18)21-16-9-8-15(20)13-5-2-3-6-14(13)16/h2-9,12,17,19-20H,10-11H2,1H3/t17-/m0/s1
• InChIKey: DRRXQCXSBONKPD-KRWDZBQOSA-N

Properties

• Density: 1.2±0.1g/cm³ (Cal.)
• Boiling point: 516.6±50.0°C at 760 mmHg (Cal.)
• Flash point: 266.2±30.1°C (Cal.)
• Refractive index: 1.649 (Cal.)