Dimethyl 1-benzothiophene-2,5-dicarboxylate
[CAS# 7345-76-8]

Identification

• Name: Dimethyl 1-benzothiophene-2,5-dicarboxylate
• Synonyms: Benzo[b]thiophene-2,5-dicarboxylic acid, 2,5-dimethyl ester; Dimethyl 1-benzothiophene-2,5-dicarboxylate #
• Molecular Formula: C₁₂H₁₀O₄S
• Molecular Weight: 250.27
• CAS Registry Number: 7345-76-8
• SMILES: O=C(OC)c2cc1c(sc(c1)C(=O)OC)cc2
• InChI: 1S/C12H10O4S/c1-15-11(13)7-3-4-9-8(5-7)6-10(17-9)12(14)16-2/h3-6H,1-2H3
• InChIKey: XHEKZPXGTIMGQC-UHFFFAOYSA-N

Properties

• Density: 1.325g/cm³ (Cal.)
• Boiling point: 376.221°C at 760 mmHg (Cal.)
• Flash point: 181.332°C (Cal.)