2-Pentafluorophenyl-Malonic Acid Diethyl Ester
[CAS# 1582-05-4]

Identification

• Name: 2-Pentafluorophenyl-Malonic Acid Diethyl Ester
• Synonyms: 2-(2,3,4,5,6-Pentafluorophenyl)Propanedioic Acid Diethyl Ester; 2-(2,3,4,5,6-Pentafluorophenyl)Malonic Acid Diethyl Ester; Diethyl 2-(Perfluorophenyl)Malonate
• Molecular Formula: C₁₃H₁₁F₅O₄
• Molecular Weight: 326.22
• CAS Registry Number: 1582-05-4
• SMILES: C(OC(=O)C(C1=C(F)C(=C(F)C(=C1F)F)F)C(OCC)=O)C
• InChI: 1S/C13H11F5O4/c1-3-21-12(19)6(13(20)22-4-2)5-7(14)9(16)11(18)10(17)8(5)15/h6H,3-4H2,1-2H3
• InChIKey: ILXWVDXADPLRDY-UHFFFAOYSA-N

Properties

• Density: 1.397g/cm³ (Cal.)
• Boiling point: 282.132°C at 760 mmHg (Cal.)
• Flash point: 120.598°C (Cal.)