4-Oxo-4-(4-Toluidino)But-2-Enoic Acid
[CAS# 37904-03-3]

Identification

• Name: 4-Oxo-4-(4-Toluidino)But-2-Enoic Acid
• Synonyms: (E)-4-[(4-Methylphenyl)Amino]-4-Oxobut-2-Enoic Acid; 4-[(4-Methylphenyl)Amino]-4-Oxo-But-2-Enoic Acid; (E)-4-[(4-Methylphenyl)Amino]-4-Oxo-But-2-Enoic Acid
• Molecular Formula: C₁₁H₁₁NO₃
• Molecular Weight: 205.21
• CAS Registry Number: 37904-03-3
• SMILES: C1=C(NC(\C=C\C(O)=O)=O)C=CC(=C1)C
• InChI: 1S/C11H11NO3/c1-8-2-4-9(5-3-8)12-10(13)6-7-11(14)15/h2-7H,1H3,(H,12,13)(H,14,15)/b7-6+
• InChIKey: VLWFSWMZGGZHGD-VOTSOKGWSA-N

Properties

• Density: 1.282g/cm³ (Cal.)
• Boiling point: 446.028°C at 760 mmHg (Cal.)
• Flash point: 223.55°C (Cal.)