Diethyl 2-[[[3-(2,6-Dimethylpyridin-4-Yl)-4-Fluorophenyl]Amino]Methylidene]Propanedioate
[CAS# 104431-74-5]

Identification

• Name: Diethyl 2-[[[3-(2,6-Dimethylpyridin-4-Yl)-4-Fluorophenyl]Amino]Methylidene]Propanedioate
• Synonyms: Diethyl 2-[[[3-(2,6-Dimethyl-4-Pyridyl)-4-Fluoro-Phenyl]Amino]Methylene]Propanedioate; 2-[[[3-(2,6-Dimethyl-4-Pyridyl)-4-Fluorophenyl]Amino]Methylene]Propanedioic Acid Diethyl Ester; 2-[[[3-(2,6-Dimethyl-4-Pyridyl)-4-Fluoro-Phenyl]Amino]Methylene]Malonic Acid Diethyl Ester
• Molecular Formula: C₂₁H₂₃FN₂O₄
• Molecular Weight: 386.42
• CAS Registry Number: 104431-74-5
• SMILES: C2=C(C1=CC(=NC(=C1)C)C)C(=CC=C2NC=C(C(OCC)=O)C(OCC)=O)F
• InChI: 1S/C21H23FN2O4/c1-5-27-20(25)18(21(26)28-6-2)12-23-16-7-8-19(22)17(11-16)15-9-13(3)24-14(4)10-15/h7-12,23H,5-6H2,1-4H3
• InChIKey: KYUNYRAKHOBJNA-UHFFFAOYSA-N

Properties

• Density: 1.207g/cm³ (Cal.)
• Boiling point: 445.256°C at 760 mmHg (Cal.)
• Flash point: 223.083°C (Cal.)