Pinafide
[CAS# 54824-20-3]

Identification

• Name: Pinafide
• Synonyms: Aids-128835; Aids128835; {1H-Benz[De]Isoquinoline-1,3(2H)-Dione,} {5-Nitro-2-[2-(1-Pyrrolidinyl)Ethyl]-}
• Molecular Formula: C₁₈H₁₇N₃O₄
• Molecular Weight: 339.35
• CAS Registry Number: 54824-20-3
• SMILES: C1=C3C2=C(C=C1[N+](=O)[O-])C=CC=C2C(=O)N(C3=O)CCN4CCCC4
• InChI: 1S/C18H17N3O4/c22-17-14-5-3-4-12-10-13(21(24)25)11-15(16(12)14)18(23)20(17)9-8-19-6-1-2-7-19/h3-5,10-11H,1-2,6-9H2
• InChIKey: GBOQUHPYCRYKGV-UHFFFAOYSA-N

Properties

• Density: 1.403g/cm³ (Cal.)
• Boiling point: 548.025°C at 760 mmHg (Cal.)
• Flash point: 285.235°C (Cal.)