N-(4,5-Dihydro-5-Oxo-1,2-Dithiolo[4,3-b]Pyrrol-6-Yl)Octanamide
[CAS# 92680-91-6]

Identification

• Name: N-(4,5-Dihydro-5-Oxo-1,2-Dithiolo[4,3-b]Pyrrol-6-Yl)Octanamide
• Synonyms: N-(5-Keto-4H-Dithiolo[3,4-D]Pyrrol-6-Yl)Caprylamide; N-(5-Oxo-4H-[1,2]Dithiolo[3,4-D]Pyrrol-6-Yl)Octanamide
• Molecular Formula: C₁₃H₁₈N₂O₂S₂
• Molecular Weight: 298.42
• CAS Registry Number: 92680-91-6
• SMILES: C(C(=O)NC2=C1SSC=C1NC2=O)CCCCCC
• InChI: 1S/C13H18N2O2S2/c1-2-3-4-5-6-7-10(16)15-11-12-9(8-18-19-12)14-13(11)17/h8H,2-7H2,1H3,(H,14,17)(H,15,16)
• InChIKey: KMGWVOLORMQZAF-UHFFFAOYSA-N

Properties

• Density: 1.301g/cm³ (Cal.)
• Boiling point: 530.662°C at 760 mmHg (Cal.)
• Flash point: 274.735°C (Cal.)