Methyl 4-(Isopropylsulfonyl)-3-(1H-Pyrrol-1-Yl)-2-Thiophenecarboxylate
[CAS# 175201-79-3]

Identification

• Name: Methyl 4-(Isopropylsulfonyl)-3-(1H-Pyrrol-1-Yl)-2-Thiophenecarboxylate
• Synonyms: 2-THIOPHENECARBOXYLICACID, 4-[(1-METHYLETHYL)SULFONYL]-3-(1H-PYRROL-1-YL)-, METHYL ESTER; methyl4-(isopropylsulfonyl)-3-(1H-pyrrol-1-yl)thiophene-2-carboxylate
• Molecular Formula: C₁₃H₁₅NO₄S₂
• Molecular Weight: 313.39
• CAS Registry Number: 175201-79-3
• SMILES: O=S(=O)(c2c(n1cccc1)c(sc2)C(=O)OC)C(C)C
• InChI: 1S/C13H15NO4S2/c1-9(2)20(16,17)10-8-19-12(13(15)18-3)11(10)14-6-4-5-7-14/h4-9H,1-3H3
• InChIKey: CRWUDNGHPDMEES-UHFFFAOYSA-N

Properties

• Density: 1.353g/cm³ (Cal.)
• Boiling point: 518.941°C at 760 mmHg (Cal.)
• Flash point: 267.646°C (Cal.)
• Refractive index: 1.612 (Cal.)