4-(1,3-Dithiolan-2-yl)-2-methoxyphenyl 6-(trifluoromethyl)nicotinate
[CAS# 941063-08-7]

Identification

• Name: 4-(1,3-Dithiolan-2-yl)-2-methoxyphenyl 6-(trifluoromethyl)nicotinate
• Synonyms: 3-Pyridinecarboxylic acid, 6-(trifluoromethyl)-, 4-(1,3-dithiolan-2-yl)-2-methoxyphenyl ester
• Molecular Formula: C₁₇H₁₄F₃NO₃S₂
• Molecular Weight: 401.42
• CAS Registry Number: 941063-08-7
• SMILES: FC(F)(F)c1ccc(cn1)C(=O)Oc2ccc(cc2OC)C3SCCS3
• InChI: 1S/C17H14F3NO3S2/c1-23-13-8-10(16-25-6-7-26-16)2-4-12(13)24-15(22)11-3-5-14(21-9-11)17(18,19)20/h2-5,8-9,16H,6-7H2,1H3
• InChIKey: KXDBVEFKFNDVGB-UHFFFAOYSA-N

Properties

• Density: 1.404g/cm³ (Cal.)
• Boiling point: 550.59°C at 760 mmHg (Cal.)
• Flash point: 286.787°C (Cal.)
• Refractive index: 1.586 (Cal.)