Ethyl 2-methyl-5-[(3-nitrophenyl)sulfonylamino]-1-benzofuran-3-carboxylate
[CAS# 5227-91-8]

Identification

• Name: Ethyl 2-methyl-5-[(3-nitrophenyl)sulfonylamino]-1-benzofuran-3-carboxylate
• Synonyms: Ethyl 2-Methyl-5-[(3-Nitrophenyl)Sulfonylamino]Benzofuran-3-Carboxylate; 2-Methyl-5-[(3-Nitrophenyl)Sulfonylamino]-3-Benzofurancarboxylic Acid Ethyl Ester; 2-Methyl-5-[(3-Nitrophenyl)Sulfonylamino]Benzofuran-3-Carboxylic Acid Ethyl Ester
• Molecular Formula: C₁₈H₁₆N₂O₇S
• Molecular Weight: 404.39
• CAS Registry Number: 5227-91-8
• SMILES: C1=C([N+]([O-])=O)C=CC=C1[S](NC3=CC2=C(OC(=C2C(=O)OCC)C)C=C3)(=O)=O
• InChI: 1S/C18H16N2O7S/c1-3-26-18(21)17-11(2)27-16-8-7-12(9-15(16)17)19-28(24,25)14-6-4-5-13(10-14)20(22)23/h4-10,19H,3H2,1-2H3
• InChIKey: NNOHEQGDSBEQHA-UHFFFAOYSA-N

Properties

• Density: 1.455g/cm³ (Cal.)
• Boiling point: 572.696°C at 760 mmHg (Cal.)
• Flash point: 300.156°C (Cal.)