3,4-Dihydro-alpha-Methyl-2-Isopropyl-4-Oxo-2H-1-Benzopyran-6-Acetic Acid
[CAS# 58282-60-3]

Identification

• Name: 3,4-Dihydro-alpha-Methyl-2-Isopropyl-4-Oxo-2H-1-Benzopyran-6-Acetic Acid
• Synonyms: 2-(2-Isopropyl-4-Oxo-Chroman-6-Yl)Propanoic Acid; 2-(2-Isopropyl-4-Oxo-6-Chromanyl)Propanoic Acid; 2-(2-Isopropyl-4-Keto-Chroman-6-Yl)Propionic Acid
• Molecular Formula: C₁₅H₁₈O₄
• Molecular Weight: 262.30
• CAS Registry Number: 58282-60-3
• SMILES: C1=C(C=CC2=C1C(=O)CC(O2)C(C)C)C(C(=O)O)C
• InChI: 1S/C15H18O4/c1-8(2)14-7-12(16)11-6-10(9(3)15(17)18)4-5-13(11)19-14/h4-6,8-9,14H,7H2,1-3H3,(H,17,18)
• InChIKey: IMEPSBLHFMECET-UHFFFAOYSA-N

Properties

• Density: 1.189g/cm³ (Cal.)
• Boiling point: 432.631°C at 760 mmHg (Cal.)
• Flash point: 160.786°C (Cal.)