(5-Acetyl-1-methyl-1H-pyrrol-2-yl)methanesulfonic acid
[CAS# 794471-71-9]

Identification

• Name: (5-Acetyl-1-methyl-1H-pyrrol-2-yl)methanesulfonic acid
• Synonyms: (5-acetyl-1-methyl-1H-pyrrol-2-yl)methanesulfonic acid; 1H-PYRROLE-2-METHANESULFONICACID, 5-ACETYL-1-METHYL-
• Molecular Formula: C₈H₁₁NO₄S
• Molecular Weight: 217.24
• CAS Registry Number: 794471-71-9
• SMILES: O=C(c1ccc(n1C)CS(=O)(=O)O)C
• InChI: 1S/C8H11NO4S/c1-6(10)8-4-3-7(9(8)2)5-14(11,12)13/h3-4H,5H2,1-2H3,(H,11,12,13)
• InChIKey: KWFNPUIEJWYFJV-UHFFFAOYSA-N

Properties

• Density: 1.386g/cm³ (Cal.)
• Refractive index: 1.576 (Cal.)