2-tert-butyl-7-fluoro-5-nitro-1H-indole
[CAS# 952664-94-7]

Identification

• Name: 2-tert-butyl-7-fluoro-5-nitro-1H-indole
• Synonyms: 2-tert-butyl-7-fluoro-5-nitro-1H-indole
• Molecular Formula: C₁₂H₁₃FN₂O₂
• Molecular Weight: 236.24
• CAS Registry Number: 952664-94-7
• SMILES: CC(C)(C)c1cc2cc(cc(c2[nH]1)F)[N+](=O)[O-]
• InChI: 1S/C12H13FN2O2/c1-12(2,3)10-5-7-4-8(15(16)17)6-9(13)11(7)14-10/h4-6,14H,1-3H3
• InChIKey: YOBUTELENUBOFS-UHFFFAOYSA-N

Properties

• Density: 1.28g/cm³ (Cal.)
• Boiling point: 380.593°C at 760 mmHg (Cal.)
• Flash point: 183.976°C (Cal.)
• Refractive index: 1.604 (Cal.)