(5-Butoxy-3-Methylphenyl)Acetic Acid
[CAS# 51028-85-4]

Identification

• Name: (5-Butoxy-3-Methylphenyl)Acetic Acid
• Synonyms: 2-(3-Butoxy-5-Methyl-Phenyl)Acetic Acid; 2-(3-Butoxy-5-Methyl-Phenyl)Ethanoic Acid; Acetic Acid, (5-Butoxy-M-Tolyl)-
• Molecular Formula: C₁₃H₁₈O₃
• Molecular Weight: 222.28
• CAS Registry Number: 51028-85-4
• SMILES: C1=C(C)C=C(CC(O)=O)C=C1OCCCC
• InChI: 1S/C13H18O3/c1-3-4-5-16-12-7-10(2)6-11(8-12)9-13(14)15/h6-8H,3-5,9H2,1-2H3,(H,14,15)
• InChIKey: PGXJZASUGQVGNJ-UHFFFAOYSA-N

Properties

• Density: 1.076g/cm³ (Cal.)
• Boiling point: 362.944°C at 760 mmHg (Cal.)
• Flash point: 134.505°C (Cal.)