Ethyl (2-Acetamido-5-Fluoro-4-Isothiocyanatophenoxy)Acetate
[CAS# 147379-38-2]

Identification

• Name: Ethyl (2-Acetamido-5-Fluoro-4-Isothiocyanatophenoxy)Acetate
• Synonyms: (2-Acétamido-5-fluoro-4-isothiocyanatophénoxy)acétate d'éthyle; Acetic acid, 2-[2-(acetylamino)-5-fluoro-4-isothiocyanatophenoxy]-, ethyl ester; Ethyl (2-acetamido-5-fluoro-4-isothiocyanatophenoxy)acetate
• Molecular Formula: C₁₃H₁₃FN₂O₄S
• Molecular Weight: 312.32
• CAS Registry Number: 147379-38-2
• SMILES: CCOC(=O)COc1cc(c(cc1NC(=O)C)N=C=S)F
• InChI: 1S/C13H13FN2O4S/c1-3-19-13(18)6-20-12-4-9(14)10(15-7-21)5-11(12)16-8(2)17/h4-5H,3,6H2,1-2H3,(H,16,17)
• InChIKey: LGPDZCUSKSYBKL-UHFFFAOYSA-N

Properties

• Density: 1.3±0.1g/cm³ (Cal.)
• Boiling point: 463.6±45.0°C at 760 mmHg (Cal.)
• Flash point: 234.2±28.7°C (Cal.)
• Refractive index: 1.557 (Cal.)