5-(4,4-Dimethyl-2-Oxo-1,4-Dihydro-2H-3,1-Benzoxazin-6-Yl)-2-Fluorobenzonitrile
[CAS# 304854-07-7]

Identification

• Name: 5-(4,4-Dimethyl-2-Oxo-1,4-Dihydro-2H-3,1-Benzoxazin-6-Yl)-2-Fluorobenzonitrile
• Synonyms: 5-(4,4-Dimethyl-2-oxo-1,4-dihydro-2H-benzo[d][1,3]oxazin-6-yl)-2-fluoro-benzonitrile; 5-(4,4-dimethyl-2-oxo-2,4-dihydro-1H-benzo[d][1,3]oxazin-6-yl)-2-fluorobenzonitrile; BENZONITRILE,5-(1,4-DIHYDRO-4,4-DIMETHYL-2-OXO-2H-3,1-BENZOXAZIN-6-YL)-2-FLUORO-
• Molecular Formula: C₁₇H₁₃FN₂O₂
• Molecular Weight: 296.30
• CAS Registry Number: 304854-07-7
• SMILES: CC1(C2=C(C=CC(=C2)C3=CC(=C(C=C3)F)C#N)NC(=O)O1)C
• InChI: 1S/C17H13FN2O2/c1-17(2)13-8-11(4-6-15(13)20-16(21)22-17)10-3-5-14(18)12(7-10)9-19/h3-8H,1-2H3,(H,20,21)
• InChIKey: QYXWQJJMCRIUKE-UHFFFAOYSA-N

Properties

• Density: 1.3±0.1g/cm³ (Cal.)
• Boiling point: 404.3±45.0°C at 760 mmHg (Cal.)
• Flash point: 198.3±28.7°C (Cal.)
• Refractive index: 1.623 (Cal.)