Diethyl {[(2,3,4-Trifluorophenyl)Amino]Methylene}Malonate
[CAS# 100501-60-8]

Identification

• Name: Diethyl {[(2,3,4-Trifluorophenyl)Amino]Methylene}Malonate
• Synonyms: 1,3-diethyl 2-{[(2,3,4-trifluorophenyl)amino]methylidene}propanedioate; Diethyl {[(2,3,4-trifluorophenyl)amino]methylene}malonate; Diethyl {[(2,3,4-trifluorophenyl)amino]-methylene}malonate
• Molecular Formula: C₁₄H₁₄F₃NO₄
• Molecular Weight: 317.26
• CAS Registry Number: 100501-60-8
• SMILES: O=C(OCC)/C(=C\Nc1ccc(F)c(F)c1F)C(=O)OCC
• InChI: 1S/C14H14F3NO4/c1-3-21-13(19)8(14(20)22-4-2)7-18-10-6-5-9(15)11(16)12(10)17/h5-7,18H,3-4H2,1-2H3
• InChIKey: KSWGDSAIUPPJIB-UHFFFAOYSA-N

Properties

• Density: 1.336g/cm³ (Cal.)
• Melting point: 89-95°C (Expl.)
• Boiling point: 321.667°C at 760 mmHg (Cal.)
• Flash point: 148.339°C (Cal.)
• Refractive index: 1.516 (Cal.)

Safety Data

• Safety Description: IRRITANT