4,4,4-Trifluoro-1-(4-Nitrophenyl)-3-(Trifluoromethyl)But-2-En-1-One
[CAS# 35443-90-4]

Identification

• Name: 4,4,4-Trifluoro-1-(4-Nitrophenyl)-3-(Trifluoromethyl)But-2-En-1-One
• Synonyms: 1-(P-Nitrophenyl)-4,4,4-Trifluoro-3-Trifluoromethyl-2-Buten-1-One; Brn 2168162; Crotonophenone, 4'-Nitro-4,4,4-Trifluoro-3-(Trifluoromethyl)-
• Molecular Formula: C₁₁H₅F₆NO₃
• Molecular Weight: 313.16
• CAS Registry Number: 35443-90-4
• SMILES: C1=C(C(=O)C=C(C(F)(F)F)C(F)(F)F)C=CC(=C1)[N+]([O-])=O
• InChI: 1S/C11H5F6NO3/c12-10(13,14)9(11(15,16)17)5-8(19)6-1-3-7(4-2-6)18(20)21/h1-5H
• InChIKey: UVIHANWKDUFDPA-UHFFFAOYSA-N

Properties

• Density: 1.502g/cm³ (Cal.)
• Boiling point: 368.089°C at 760 mmHg (Cal.)
• Flash point: 176.414°C (Cal.)