(E)-3-Phenylpropenoic Acid [2-[4-(Hydroxymethyl)-2-(2-Methyl-1-Oxopropoxy)Phenyl]Oxiranyl]Methyl Ester
[CAS# 80235-04-7]

Identification

• Name: (E)-3-Phenylpropenoic Acid [2-[4-(Hydroxymethyl)-2-(2-Methyl-1-Oxopropoxy)Phenyl]Oxiranyl]Methyl Ester
• Synonyms: 2-Methylpropanoic Acid [5-(Hydroxymethyl)-2-[2-[[(E)-1-Oxo-3-Phenylprop-2-Enoxy]Methyl]-2-Oxiranyl]Phenyl] Ester; 2-Methylpropionic Acid [5-Methylol-2-[2-[[(E)-3-Phenylacryloyl]Oxymethyl]Oxiran-2-Yl]Phenyl] Ester; 2-Propenoic Acid, 3-Phenyl-, (2-(4-(Hydroxymethyl)-2-(2-Methyl-1-Oxopropoxy)Phenyl)Oxiranyl)Methyl Ester, (2E)-
• Molecular Formula: C₂₃H₂₄O₆
• Molecular Weight: 396.44
• CAS Registry Number: 80235-04-7
• SMILES: C3=C(C1(OC1)COC(/C=C/C2=CC=CC=C2)=O)C(=CC(=C3)CO)OC(=O)C(C)C
• InChI: 1S/C23H24O6/c1-16(2)22(26)29-20-12-18(13-24)8-10-19(20)23(15-28-23)14-27-21(25)11-9-17-6-4-3-5-7-17/h3-12,16,24H,13-15H2,1-2H3/b11-9+
• InChIKey: AIUGIYMSXFPBFA-PKNBQFBNSA-N

Properties

• Density: 1.246g/cm³ (Cal.)
• Boiling point: 573.408°C at 760 mmHg (Cal.)
• Flash point: 197.145°C (Cal.)