(E)-4-Oxo-4-(2,4,6-Trimethylphenyl)But-2-Enoic Acid
[CAS# 6313-01-5]

Identification

• Name: (E)-4-Oxo-4-(2,4,6-Trimethylphenyl)But-2-Enoic Acid
• Synonyms: (E)-4-Oxo-4-(2,4,6-Trimethylphenyl)But-2-Enoic Acid; (E)-4-Keto-4-(2,4,6-Trimethylphenyl)But-2-Enoic Acid; 4-Keto-4-(2,4,6-Trimethylphenyl)But-2-Enoic Acid
• Molecular Formula: C₁₃H₁₄O₃
• Molecular Weight: 218.25
• CAS Registry Number: 6313-01-5
• SMILES: C1=C(C)C=C(C(=C1C)C(\C=C\C(O)=O)=O)C
• InChI: 1S/C13H14O3/c1-8-6-9(2)13(10(3)7-8)11(14)4-5-12(15)16/h4-7H,1-3H3,(H,15,16)/b5-4+
• InChIKey: YZAVQWHPGAFDIH-SNAWJCMRSA-N

Properties

• Density: 1.142g/cm³ (Cal.)
• Boiling point: 406.931°C at 760 mmHg (Cal.)
• Flash point: 214.062°C (Cal.)