4-(Benzoyl)-3-Sulfamoyl-5-(Thiophen-3-Ylmethoxy)Benzoic Acid
[CAS# 54591-38-7]

Identification

• Name: 4-(Benzoyl)-3-Sulfamoyl-5-(Thiophen-3-Ylmethoxy)Benzoic Acid
• Synonyms: 4-(Benzoyl)-3-Sulfamoyl-5-(3-Thienylmethoxy)Benzoic Acid; 4-(Oxo-Phenylmethyl)-3-Sulfamoyl-5-(3-Thienylmethoxy)Benzoic Acid; 4-Phenylcarbonyl-3-Sulfamoyl-5-(Thiophen-3-Ylmethoxy)Benzoic Acid
• Molecular Formula: C₁₉H₁₅NO₆S₂
• Molecular Weight: 417.45
• CAS Registry Number: 54591-38-7
• SMILES: C1=CC(=CS1)COC2=C(C(=CC(=C2)C(O)=O)[S](=O)(=O)N)C(=O)C3=CC=CC=C3
• InChI: 1S/C19H15NO6S2/c20-28(24,25)16-9-14(19(22)23)8-15(26-10-12-6-7-27-11-12)17(16)18(21)13-4-2-1-3-5-13/h1-9,11H,10H2,(H,22,23)(H2,20,24,25)
• InChIKey: QYUPPINXPFCSIM-UHFFFAOYSA-N

Properties

• Density: 1.474g/cm³ (Cal.)
• Boiling point: 732.266°C at 760 mmHg (Cal.)
• Flash point: 396.661°C (Cal.)