5-[(4-Hydroxy-3-Nitrophenyl)Methyl]-3-Phenyl-2-Sulfanylideneimidazolidin-4-One
[CAS# 105956-89-6]

Identification

• Name: 5-[(4-Hydroxy-3-Nitrophenyl)Methyl]-3-Phenyl-2-Sulfanylideneimidazolidin-4-One
• Synonyms: 5-[(4-Hydroxy-3-Nitro-Phenyl)Methyl]-3-Phenyl-2-Thioxo-Imidazolidin-4-One; 5-[(4-Hydroxy-3-Nitrophenyl)Methyl]-3-Phenyl-2-Thioxo-4-Imidazolidinone; 5-(4-Hydroxy-3-Nitro-Benzyl)-3-Phenyl-2-Thioxo-Imidazolidin-4-One
• Molecular Formula: C₁₆H₁₃N₃O₄S
• Molecular Weight: 343.36
• CAS Registry Number: 105956-89-6
• SMILES: C1=C([N+]([O-])=O)C(=CC=C1CC2NC(=S)N(C2=O)C3=CC=CC=C3)O
• InChI: 1S/C16H13N3O4S/c20-14-7-6-10(9-13(14)19(22)23)8-12-15(21)18(16(24)17-12)11-4-2-1-3-5-11/h1-7,9,12,20H,8H2,(H,17,24)
• InChIKey: VVSHMQNALJOXIA-UHFFFAOYSA-N

Properties

• Density: 1.545g/cm³ (Cal.)
• Boiling point: 506.361°C at 760 mmHg (Cal.)
• Flash point: 260.038°C (Cal.)