3-Acetyl-2-Oxo-alpha-Chromene-6-Carboxylic Acid Isopropyl Ester
[CAS# 6468-76-4]

Identification

• Name: 3-Acetyl-2-Oxo-alpha-Chromene-6-Carboxylic Acid Isopropyl Ester
• Synonyms: Isopropyl 3-Acetyl-2-Oxo-Chromene-6-Carboxylate; 3-Acetyl-2-Oxo-6-Chromenecarboxylic Acid Isopropyl Ester; 3-Acetyl-2-Keto-Chromene-6-Carboxylic Acid Isopropyl Ester
• Molecular Formula: C₁₅H₁₄O₅
• Molecular Weight: 274.27
• CAS Registry Number: 6468-76-4
• SMILES: C1=C(C=CC2=C1C=C(C(O2)=O)C(=O)C)C(OC(C)C)=O
• InChI: 1S/C15H14O5/c1-8(2)19-14(17)10-4-5-13-11(6-10)7-12(9(3)16)15(18)20-13/h4-8H,1-3H3
• InChIKey: JVEISLFWHJXENT-UHFFFAOYSA-N

Properties

• Density: 1.26g/cm³ (Cal.)
• Boiling point: 471.15°C at 760 mmHg (Cal.)
• Flash point: 211.549°C (Cal.)