1-Methyl-2-(1-nitro-2-heptanyl)-1H-pyrrole
[CAS# 820232-97-1]

Identification

• Name: 1-Methyl-2-(1-nitro-2-heptanyl)-1H-pyrrole
• Synonyms: 1-methyl-2-(1-nitroheptan-2-yl)-1H-pyrrole
• Molecular Formula: C₁₂H₂₀N₂O₂
• Molecular Weight: 224.30
• CAS Registry Number: 820232-97-1
• SMILES: CCCCCC(C[N+](=O)[O-])c1cccn1C
• InChI: 1S/C12H20N2O2/c1-3-4-5-7-11(10-14(15)16)12-8-6-9-13(12)2/h6,8-9,11H,3-5,7,10H2,1-2H3
• InChIKey: UDWYXVQHBOHDSB-UHFFFAOYSA-N

Properties

• Density: 1.059g/cm³ (Cal.)
• Boiling point: 340.474°C at 760 mmHg (Cal.)
• Flash point: 159.713°C (Cal.)
• Refractive index: 1.522 (Cal.)