6-Methyl-5-(2-Thenoyl)-5H-1,3-Dioxolo[4,5-f]Indole-7-Acetic Acid
[CAS# 50332-08-6]

Identification

• Name: 6-Methyl-5-(2-Thenoyl)-5H-1,3-Dioxolo[4,5-f]Indole-7-Acetic Acid
• Synonyms: 2-[6-Methyl-5-[Oxo-(2-Thienyl)Methyl]-[1,3]Dioxolo[4,5-F]Indol-7-Yl]Acetic Acid; 2-(6-Methyl-5-Thiophen-2-Ylcarbonyl-[1,3]Dioxolo[4,5-F]Indol-7-Yl)Ethanoic Acid; 6-Methyl-5-(2-Thenoyl)-5H-1,3-Dioxolo(4,5-F)Indole-7-Acetic Acid
• Molecular Formula: C₁₇H₁₃NO₅S
• Molecular Weight: 343.35
• CAS Registry Number: 50332-08-6
• SMILES: C1=C4C(=CC2=C1[N](C(=C2CC(O)=O)C)C(C3=CC=CS3)=O)OCO4
• InChI: 1S/C17H13NO5S/c1-9-10(6-16(19)20)11-5-13-14(23-8-22-13)7-12(11)18(9)17(21)15-3-2-4-24-15/h2-5,7H,6,8H2,1H3,(H,19,20)
• InChIKey: HHWDIOVTZBAVKQ-UHFFFAOYSA-N

Properties

• Density: 1.55g/cm³ (Cal.)
• Boiling point: 489.9°C at 760 mmHg (Cal.)
• Flash point: 250.083°C (Cal.)