(2E)-3-[6-(Trifluoromethyl)-3-pyridinyl]acrylic acid
[CAS# 944805-93-0]

Identification

• Name: (2E)-3-[6-(Trifluoromethyl)-3-pyridinyl]acrylic acid
• Synonyms: (2E)-3-[2-(Trifluoromethyl)pyridin-5-yl]propenoic acid; (2E)-3-[6-(trifluoromethyl)(3-pyridyl)]prop-2-enoic acid; (2E)-3-[6-(Trifluoromethyl)pyridin-3-yl]prop-2-enoic acid
• Molecular Formula: C₉H₆F₃NO₂
• Molecular Weight: 217.14
• CAS Registry Number: 944805-93-0
• SMILES: FC(F)(F)c1ncc(\C=C\C(=O)O)cc1
• InChI: 1S/C9H6F3NO2/c10-9(11,12)7-3-1-6(5-13-7)2-4-8(14)15/h1-5H,(H,14,15)/b4-2+
• InChIKey: ATQAZNAOJJOPTL-DUXPYHPUSA-N

Properties

• Density: 1.431g/cm³ (Cal.)
• Melting point: 232-236°C (Expl.)
• Boiling point: 284.731°C at 760 mmHg (Cal.)
• Flash point: 126.001°C (Cal.)
• Refractive index: 1.529 (Cal.)

Safety Data

• Safety Description: S22,S24/25,S36/37/39,S45