6-Butyl-4-Nitroquinoline 1-Oxide
[CAS# 21070-32-6]

Identification

• Name: 6-Butyl-4-Nitroquinoline 1-Oxide
• Synonyms: 6-Butyl-4-Nitro-1-Oxido-Quinolin-1-Ium; 6-Butyl-4-Nitroquinoline 1-Oxide; Brn 1249953
• Molecular Formula: C₁₃H₁₄N₂O₃
• Molecular Weight: 246.27
• CAS Registry Number: 21070-32-6
• SMILES: C2=CC1=C(C(=CC=[N+]1[O-])[N+]([O-])=O)C=C2CCCC
• InChI: 1S/C13H14N2O3/c1-2-3-4-10-5-6-12-11(9-10)13(15(17)18)7-8-14(12)16/h5-9H,2-4H2,1H3
• InChIKey: ZXRKSBGQDZHLKU-UHFFFAOYSA-N

Properties

• Density: 1.247g/cm³ (Cal.)
• Boiling point: 419.924°C at 760 mmHg (Cal.)
• Flash point: 207.763°C (Cal.)