3-[1-(4-Methylphenyl)Propoxy]-3-Oxopropanoic Acid
[CAS# 101756-25-6]

Identification

• Name: 3-[1-(4-Methylphenyl)Propoxy]-3-Oxopropanoic Acid
• Synonyms: 3-[1-(4-Methylphenyl)Propoxy]-3-Oxo-Propanoic Acid; 3-Keto-3-[1-(4-Methylphenyl)Propoxy]Propionic Acid; Alpha-Ethyl-P-Methylbenzyl Ester Of Malonic Acid
• Molecular Formula: C₁₃H₁₆O₄
• Molecular Weight: 236.27
• CAS Registry Number: 101756-25-6
• SMILES: C1=C(C(OC(=O)CC(=O)O)CC)C=CC(=C1)C
• InChI: 1S/C13H16O4/c1-3-11(17-13(16)8-12(14)15)10-6-4-9(2)5-7-10/h4-7,11H,3,8H2,1-2H3,(H,14,15)
• InChIKey: DXFANIGIQOZRMR-UHFFFAOYSA-N

Properties

• Density: 1.162g/cm³ (Cal.)
• Boiling point: 378.167°C at 760 mmHg (Cal.)
• Flash point: 141.051°C (Cal.)