3-Acetyl-2-Oxo-alpha-Chromene-6-Carboxylic Acid Methyl Ester
[CAS# 6468-74-2]

Identification

• Name: 3-Acetyl-2-Oxo-alpha-Chromene-6-Carboxylic Acid Methyl Ester
• Synonyms: Methyl 3-Acetyl-2-Oxo-Chromene-6-Carboxylate; 3-Acetyl-2-Oxo-6-Chromenecarboxylic Acid Methyl Ester; 3-Acetyl-2-Keto-Chromene-6-Carboxylic Acid Methyl Ester
• Molecular Formula: C₁₃H₁₀O₅
• Molecular Weight: 246.22
• CAS Registry Number: 6468-74-2
• SMILES: C1=C(C=CC2=C1C=C(C(O2)=O)C(=O)C)C(OC)=O
• InChI: 1S/C13H10O5/c1-7(14)10-6-9-5-8(12(15)17-2)3-4-11(9)18-13(10)16/h3-6H,1-2H3
• InChIKey: GFZSZJXILLUFFN-UHFFFAOYSA-N

Properties

• Density: 1.336g/cm³ (Cal.)
• Boiling point: 465.901°C at 760 mmHg (Cal.)
• Flash point: 211.627°C (Cal.)