3,5,6-Trimethoxy-2,3-dihydro-1-benzothiophene-3-carboxylic acid
[CAS# 94157-96-7]

Identification

• Name: 3,5,6-Trimethoxy-2,3-dihydro-1-benzothiophene-3-carboxylic acid
• Synonyms: 3,5,6-trimethoxybenzo[b]thiophene-3-carboxylic acid
• Molecular Formula: C₁₂H₁₄O₅S
• Molecular Weight: 270.30
• CAS Registry Number: 94157-96-7
• EINECS: 303-065-6
• SMILES: OC(=O)C2(CSc1cc(OC)c(cc12)OC)OC
• InChI: 1S/C12H14O5S/c1-15-8-4-7-10(5-9(8)16-2)18-6-12(7,17-3)11(13)14/h4-5H,6H2,1-3H3,(H,13,14)
• InChIKey: PRWPUUZYDQEFBG-UHFFFAOYSA-N

Properties

• Density: 1.377g/cm³ (Cal.)
• Boiling point: 441.807°C at 760 mmHg (Cal.)
• Flash point: 220.997°C (Cal.)