4-{3-[5-(Diethylamino)-2-furyl]-2,5-dioxo-4-(phenylsulfonyl)-2,5-dihydro-1H-pyrrol-1-yl}benzoic acid
[CAS# 827609-74-5]

Identification

• Name: 4-{3-[5-(Diethylamino)-2-furyl]-2,5-dioxo-4-(phenylsulfonyl)-2,5-dihydro-1H-pyrrol-1-yl}benzoic acid
• Synonyms: Benzoic acid,4-[3-[5-(diethylamino)-2-furanyl]-2,5-dihydro-2,5-dioxo-4-(phenylsulfonyl)-1H-pyrrol-1-yl]-
• Molecular Formula: C₂₅H₂₂N₂O₇S
• Molecular Weight: 494.52
• CAS Registry Number: 827609-74-5
• SMILES: CCN(CC)c1ccc(o1)C2=C(C(=O)N(C2=O)c3ccc(cc3)C(=O)O)S(=O)(=O)c4ccccc4
• InChI: 1S/C25H22N2O7S/c1-3-26(4-2)20-15-14-19(34-20)21-22(35(32,33)18-8-6-5-7-9-18)24(29)27(23(21)28)17-12-10-16(11-13-17)25(30)31/h5-15H,3-4H2,1-2H3,(H,30,31)
• InChIKey: ITLWHVDRUKKUDU-UHFFFAOYSA-N

Properties

• Density: 1.438g/cm³ (Cal.)
• Boiling point: 739.399°C at 760 mmHg (Cal.)
• Flash point: 400.974°C (Cal.)
• Refractive index: 1.655 (Cal.)