(2E)-3-(4-Isobutylphenyl)-2-butenoic acid
[CAS# 91121-60-7]

Identification

• Name: (2E)-3-(4-Isobutylphenyl)-2-butenoic acid
• Synonyms: (E)-3-(4-isobutylphenyl)but-2-enoic acid
• Molecular Formula: C₁₄H₁₈O₂
• Molecular Weight: 218.29
• CAS Registry Number: 91121-60-7
• SMILES: O=C(O)\C=C(\c1ccc(cc1)CC(C)C)C
• InChI: 1S/C14H18O2/c1-10(2)8-12-4-6-13(7-5-12)11(3)9-14(15)16/h4-7,9-10H,8H2,1-3H3,(H,15,16)/b11-9+
• InChIKey: AJTXFXLQDWEDDG-PKNBQFBNSA-N

Properties

• Density: 1.034g/cm³ (Cal.)
• Boiling point: 337.634°C at 760 mmHg (Cal.)
• Flash point: 240.731°C (Cal.)