3-[2-Hydroxy(2-Methylpropoxy)Phenyl]-2-Propenoic Acid
[CAS# 98510-78-2]

Identification

• Name: 3-[2-Hydroxy(2-Methylpropoxy)Phenyl]-2-Propenoic Acid
• Synonyms: (E)-3-(2-Hydroxy-3-Isobutoxy-Phenyl)Prop-2-Enoic Acid; (E)-3-(2-Hydroxy-3-Isobutoxyphenyl)Prop-2-Enoic Acid; (E)-3-(2-Hydroxy-3-Isobutoxy-Phenyl)Acrylic Acid
• Molecular Formula: C₁₃H₁₆O₄
• Molecular Weight: 236.27
• CAS Registry Number: 98510-78-2
• EINECS: 308-787-5
• SMILES: C1=C(OCC(C)C)C(=C(C=C1)\C=C\C(O)=O)O
• InChI: 1S/C13H16O4/c1-9(2)8-17-11-5-3-4-10(13(11)16)6-7-12(14)15/h3-7,9,16H,8H2,1-2H3,(H,14,15)/b7-6+
• InChIKey: CAQDGHXUYYLXHM-VOTSOKGWSA-N

Properties

• Density: 1.197g/cm³ (Cal.)
• Boiling point: 396.742°C at 760 mmHg (Cal.)
• Flash point: 149.446°C (Cal.)