2-(4-Chlorophenyl)-alpha-Ethyl-3-Methoxy-4-Oxo-4H-1-Benzopyran-6-Aceticacid Methyl Ester
[CAS# 173469-85-7]

Identification

• Name: 2-(4-Chlorophenyl)-alpha-Ethyl-3-Methoxy-4-Oxo-4H-1-Benzopyran-6-Aceticacid Methyl Ester
• Synonyms: Methyl 2-[2-(4-Chlorophenyl)-3-Methoxy-4-Oxo-Chromen-6-Yl]Butanoate; 2-[2-(4-Chlorophenyl)-3-Methoxy-4-Oxo-6-Chromenyl]Butanoic Acid Methyl Ester; 2-[2-(4-Chlorophenyl)-4-Keto-3-Methoxy-Chromen-6-Yl]Butyric Acid Methyl Ester
• Molecular Formula: C₂₁H₁₉ClO₅
• Molecular Weight: 386.83
• CAS Registry Number: 173469-85-7
• SMILES: C1=C2C(=CC(=C1)C(C(=O)OC)CC)C(C(=C(O2)C3=CC=C(C=C3)Cl)OC)=O
• InChI: 1S/C21H19ClO5/c1-4-15(21(24)26-3)13-7-10-17-16(11-13)18(23)20(25-2)19(27-17)12-5-8-14(22)9-6-12/h5-11,15H,4H2,1-3H3
• InChIKey: SRXXFXJDSOTFQL-UHFFFAOYSA-N

Properties

• Density: 1.314g/cm³ (Cal.)
• Boiling point: 516.263°C at 760 mmHg (Cal.)
• Flash point: 186.334°C (Cal.)