4-[3-(5-Acetamido-2-Hydroxyphenyl)-3-Oxo-Propen-1-Yl]Benzoic Acid
[CAS# 94094-54-9]

Identification

• Name: 4-[3-(5-Acetamido-2-Hydroxyphenyl)-3-Oxo-Propen-1-Yl]Benzoic Acid
• Synonyms: 4-[(E)-3-(5-Acetamido-2-Hydroxy-Phenyl)-3-Oxo-Prop-1-Enyl]Benzoic Acid; 4-[(E)-3-(5-Acetamido-2-Hydroxy-Phenyl)-3-Keto-Prop-1-Enyl]Benzoic Acid; 4-(3-(5-Acetamido-2-Hydroxyphenyl)-3-Oxo-Propen-1-Yl)Benzoic Acid
• Molecular Formula: C₁₈H₁₅NO₅
• Molecular Weight: 325.32
• CAS Registry Number: 94094-54-9
• EINECS: 302-156-8
• SMILES: C1=C(NC(=O)C)C=CC(=C1C(=O)\C=C\C2=CC=C(C=C2)C(=O)O)O
• InChI: 1S/C18H15NO5/c1-11(20)19-14-7-9-17(22)15(10-14)16(21)8-4-12-2-5-13(6-3-12)18(23)24/h2-10,22H,1H3,(H,19,20)(H,23,24)/b8-4+
• InChIKey: PXFJWEXRMWNDBT-XBXARRHUSA-N

Properties

• Density: 1.391g/cm³ (Cal.)
• Boiling point: 660.012°C at 760 mmHg (Cal.)
• Flash point: 352.963°C (Cal.)