1-[2-Hydroxy-5-(1-Hydroxyethyl)Phenyl]-3-Methylbut-2-En-1-One
[CAS# 79694-79-4]

Identification

• Name: 1-[2-Hydroxy-5-(1-Hydroxyethyl)Phenyl]-3-Methylbut-2-En-1-One
• Synonyms: 1-[2-Hydroxy-5-(1-Hydroxyethyl)Phenyl]-3-Methyl-But-2-En-1-One; 2-Buten-1-One, 1-(2-Hydroxy-5-(1-Hydroxyethyl)Phenyl)-3-Methyl-
• Molecular Formula: C₁₃H₁₆O₃
• Molecular Weight: 220.27
• CAS Registry Number: 79694-79-4
• SMILES: C1=C(C(C=C(C)C)=O)C(=CC=C1C(O)C)O
• InChI: 1S/C13H16O3/c1-8(2)6-13(16)11-7-10(9(3)14)4-5-12(11)15/h4-7,9,14-15H,1-3H3
• InChIKey: BOYBLQMJGIRKDQ-UHFFFAOYSA-N

Properties

• Density: 1.139g/cm³ (Cal.)
• Boiling point: 386.67°C at 760 mmHg (Cal.)
• Flash point: 201.822°C (Cal.)