4-Nitro-1-Oxido-6-Tert-Butyl-Quinoline
[CAS# 23484-01-7]

Identification

• Name: 4-Nitro-1-Oxido-6-Tert-Butyl-Quinoline
• Synonyms: 6-Tert-Butyl-4-Nitro-1-Oxido-Quinolin-1-Ium; Quinoline, 6-Tert-Butyl-4-Nitro-, 1-Oxide; 6-Tert-Butyl-4-Nitroquinoline 1-Oxide
• Molecular Formula: C₁₃H₁₄N₂O₃
• Molecular Weight: 246.27
• CAS Registry Number: 23484-01-7
• SMILES: C2=C(C(C)(C)C)C=C1C(=CC=[N+](C1=C2)[O-])[N+]([O-])=O
• InChI: 1S/C13H14N2O3/c1-13(2,3)9-4-5-11-10(8-9)12(15(17)18)6-7-14(11)16/h4-8H,1-3H3
• InChIKey: QUOJAXJCOKSDHL-UHFFFAOYSA-N

Properties

• Density: 1.225g/cm³ (Cal.)
• Boiling point: 404.227°C at 760 mmHg (Cal.)
• Flash point: 198.27°C (Cal.)