3,4-Dihydro-2H-Thieno[3,4-b][1,4]Dioxepine-6,8-Dicarboxylic Acid
[CAS# 177364-98-6]

Identification

• Name: 3,4-Dihydro-2H-Thieno[3,4-b][1,4]Dioxepine-6,8-Dicarboxylic Acid
• Synonyms: 2,3-Dihydro-2H-thieno[3,4-b][1,4]dioxepin-6,8-dicarboxylic acid; 2H,3H,4H-thieno[3,4-b][1,4]dioxepine-6,8-dicarboxylic acid; 2H-THIENO[3,4-B][1,4]DIOXEPIN-6,8-DICARBOXYLICACID, 3,4-DIHYDRO-
• Molecular Formula: C₉H₈O₆S
• Molecular Weight: 244.22
• CAS Registry Number: 177364-98-6
• SMILES: C1COC2=C(SC(=C2OC1)C(=O)O)C(=O)O
• InChI: 1S/C9H8O6S/c10-8(11)6-4-5(7(16-6)9(12)13)15-3-1-2-14-4/h1-3H2,(H,10,11)(H,12,13)
• InChIKey: MCLQXEPXGNPDHG-UHFFFAOYSA-N

Properties

• Density: 1.6±0.1g/cm³ (Cal.)
• Boiling point: 482.6±45.0°C at 760 mmHg (Cal.)
• Flash point: 245.7±28.7°C (Cal.)
• Refractive index: 1.634 (Cal.)