2-Methyl-5-Nitro-1(2H)-Isoquinolinone
[CAS# 42792-96-1]

Identification

• Name: 2-Methyl-5-Nitro-1(2H)-Isoquinolinone
• Synonyms: 2-Methyl-5-Nitro-Isoquinolin-1-One; 2-Methyl-5-Nitro-1-Isoquinolinone; 2-Methyl-5-Nitro-Isocarbostyril
• Molecular Formula: C₁₀H₈N₂O₃
• Molecular Weight: 204.18
• CAS Registry Number: 42792-96-1
• SMILES: C1=C2C(=C([N+]([O-])=O)C=C1)C=CN(C2=O)C
• InChI: 1S/C10H8N2O3/c1-11-6-5-7-8(10(11)13)3-2-4-9(7)12(14)15/h2-6H,1H3
• InChIKey: ZJFKSSNHLIRRHQ-UHFFFAOYSA-N

Properties

• Density: 1.371g/cm³ (Cal.)
• Boiling point: 401.364°C at 760 mmHg (Cal.)
• Flash point: 196.538°C (Cal.)