5-Tert-Butyl-2-[2-(4-Fluoro-Phenoxy)-Ethyl]-2,4-Dihydro-Pyrazol-3-One
[CAS# 864685-46-1]

Identification

• Name: 5-Tert-Butyl-2-[2-(4-Fluoro-Phenoxy)-Ethyl]-2,4-Dihydro-Pyrazol-3-One
• Synonyms: Fs005027
• Molecular Formula: C₁₅H₁₉FN₂O₂
• Molecular Weight: 278.33
• CAS Registry Number: 864685-46-1
• SMILES: C2=C(OCCN1N=C(C(C)(C)C)CC1=O)C=CC(=C2)F
• InChI: 1S/C15H19FN2O2/c1-15(2,3)13-10-14(19)18(17-13)8-9-20-12-6-4-11(16)5-7-12/h4-7H,8-10H2,1-3H3
• InChIKey: LIKVYAPIPIVTRQ-UHFFFAOYSA-N

Properties

• Density: 1.15g/cm³ (Cal.)
• Boiling point: 385.714°C at 760 mmHg (Cal.)
• Flash point: 187.074°C (Cal.)