N-(6-Oxo-6H-Anthra[9,1-cd]Isothiazol-7-Yl)Propionamide
[CAS# 50988-02-8]

Identification

• Name: N-(6-Oxo-6H-Anthra[9,1-cd]Isothiazol-7-Yl)Propionamide
• Synonyms: N-(6-Oxo-6H-Anthra(9,1-Cd)Isothiazol-7-Yl)Propionamide; Propanamide, N-(6-Oxo-6H-Anthra(9,1-Cd)Isothiazol-7-Yl)-
• Molecular Formula: C₁₇H₁₂N₂O₂S
• Molecular Weight: 308.35
• CAS Registry Number: 50988-02-8
• EINECS: 256-897-6
• SMILES: C1=C2C(=C(NC(=O)CC)C=C1)C(=O)C4=C3C2=NSC3=CC=C4
• InChI: 1S/C17H12N2O2S/c1-2-13(20)18-11-7-3-5-9-14(11)17(21)10-6-4-8-12-15(10)16(9)19-22-12/h3-8H,2H2,1H3,(H,18,20)
• InChIKey: AMXYNQQEZKMKJU-UHFFFAOYSA-N

Properties

• Density: 1.46g/cm³ (Cal.)
• Boiling point: 524.098°C at 760 mmHg (Cal.)
• Flash point: 270.765°C (Cal.)