4'-Fluoro-Γ-[8-(Trifluoromethyl)-3-Azaspiro[5.5]Undec-3-Yl]Butyrophenone
[CAS# 21704-21-2]

Identification

• Name: 4'-Fluoro-Γ-[8-(Trifluoromethyl)-3-Azaspiro[5.5]Undec-3-Yl]Butyrophenone
• Synonyms: 4'-Fluoro-4-(8-(Trifluoromethyl)-3-Azaspiro(5.5)Undec-3-Yl)Butyrophenone; Butyrophenone, 4'-Fluoro-4-(8-(Trifluoromethyl)-3-Azaspiro(5.5)Undec-3-Yl)-
• Molecular Formula: C₂₁H₂₇F₄NO
• Molecular Weight: 385.44
• CAS Registry Number: 21704-21-2
• SMILES: C3=C(C(CCCN2CCC1(CC(CCC1)C(F)(F)F)CC2)=O)C=CC(=C3)F
• InChI: 1S/C21H27F4NO/c22-18-7-5-16(6-8-18)19(27)4-2-12-26-13-10-20(11-14-26)9-1-3-17(15-20)21(23,24)25/h5-8,17H,1-4,9-15H2
• InChIKey: CLRQXMRTTXJHLG-UHFFFAOYSA-N

Properties

• Density: 1.196g/cm³ (Cal.)
• Boiling point: 453.956°C at 760 mmHg (Cal.)
• Flash point: 228.344°C (Cal.)