4-[(3-Ethylphenyl)Amino]-4-Oxobutanoic Acid
[CAS# 550312-50-0]

Identification

• Name: 4-[(3-Ethylphenyl)Amino]-4-Oxobutanoic Acid
• Synonyms: 3-[N-(3-ethylphenyl)carbamoyl]propanoic acid; 4-((3-ethylphenyl)amino)-4-oxobutanoic acid; 4-(3-ethylanilino)-4-oxobutanoic acid
• Molecular Formula: C₁₂H₁₅NO₃
• Molecular Weight: 221.25
• CAS Registry Number: 550312-50-0
• SMILES: CCC1=CC(=CC=C1)NC(=O)CCC(=O)O
• InChI: 1S/C12H15NO3/c1-2-9-4-3-5-10(8-9)13-11(14)6-7-12(15)16/h3-5,8H,2,6-7H2,1H3,(H,13,14)(H,15,16)
• InChIKey: IZJIRCVZHFGXPI-UHFFFAOYSA-N

Properties

• Density: 1.2±0.1g/cm³ (Cal.)
• Boiling point: 464.0±38.0°C at 760 mmHg (Cal.)
• Flash point: 234.4±26.8°C (Cal.)
• Refractive index: 1.58 (Cal.)

Safety Data

• Safety Description: IRRITANT