6-Methyl-5-(4-phenyl-1,3-thiazol-2-yl)-2-(trifluoromethyl)nicotinic acid
[CAS# 651004-85-2]

Identification

• Name: 6-Methyl-5-(4-phenyl-1,3-thiazol-2-yl)-2-(trifluoromethyl)nicotinic acid
• Synonyms: 6-Methyl-5-(4-phenyl-1,3-thiazol-2-yl)-2-(trifluoromethyl)nicotinicacid
• Molecular Formula: C₁₇H₁₁F₃N₂O₂S
• Molecular Weight: 364.34
• CAS Registry Number: 651004-85-2
• SMILES: CC1=NC(=C(C=C1C2=NC(=CS2)C3=CC=CC=C3)C(=O)O)C(F)(F)F
• InChI: 1S/C17H11F3N2O2S/c1-9-11(7-12(16(23)24)14(21-9)17(18,19)20)15-22-13(8-25-15)10-5-3-2-4-6-10/h2-8H,1H3,(H,23,24)
• InChIKey: AXBBYZUKIKQBNR-UHFFFAOYSA-N

Properties

• Density: 1.4±0.1g/cm³ (Cal.)
• Boiling point: 526.3±60.0°C at 760 mmHg (Cal.)
• Flash point: 272.1±32.9°C (Cal.)
• Refractive index: 1.587 (Cal.)