4-[(1Z)-3-Anilino-2-Cyano-3-Oxo-1-Propen-1-Yl]Benzoic Acid
[CAS# 340309-99-1]

Identification

• Name: 4-[(1Z)-3-Anilino-2-Cyano-3-Oxo-1-Propen-1-Yl]Benzoic Acid
• Synonyms: 4-(3-anilino-2-cyano-3-oxo-1-propen-1-yl)benzoic acid; 4-(3-anilino-2-cyano-3-oxo-1-propenyl)benzoic acid; 4-[(1Z)-2-cyano-3-oxo-3-(phenylamino)prop-1-en-1-yl]benzoic acid
• Molecular Formula: C₁₇H₁₂N₂O₃
• Molecular Weight: 292.29
• CAS Registry Number: 340309-99-1
• SMILES: C1=CC=C(C=C1)NC(=O)/C(=C\C2=CC=C(C=C2)C(=O)O)/C#N
• InChI: 1S/C17H12N2O3/c18-11-14(16(20)19-15-4-2-1-3-5-15)10-12-6-8-13(9-7-12)17(21)22/h1-10H,(H,19,20)(H,21,22)/b14-10-
• InChIKey: SGOYCINADXVYGR-UVTDQMKNSA-N

Properties

• Density: 1.4±0.1g/cm³ (Cal.)
• Boiling point: 594.4±50.0°C at 760 mmHg (Cal.)
• Flash point: 313.3±30.1°C (Cal.)
• Refractive index: 1.701 (Cal.)