Methyl 5-Cyano-1-Benzothiophene-2-Carboxylate
[CAS# 146137-93-1]

Identification

• Name: Methyl 5-Cyano-1-Benzothiophene-2-Carboxylate
• Synonyms: 5-CYANO-BENZO[B]THIOPHENE-2-CARBOXYLICACIDMETHYLESTER; Benzo[b]thiophene-2-carboxylic acid, 5-cyano-, methyl ester
• Molecular Formula: C₁₁H₇NO₂S
• Molecular Weight: 217.24
• CAS Registry Number: 146137-93-1
• SMILES: COC(=O)c1cc2cc(ccc2s1)C#N
• InChI: 1S/C11H7NO2S/c1-14-11(13)10-5-8-4-7(6-12)2-3-9(8)15-10/h2-5H,1H3
• InChIKey: YFASDULUSJYUSP-UHFFFAOYSA-N

Properties

• Density: 1.356g/cm³ (Cal.)
• Boiling point: 382.904°C at 760 mmHg (Cal.)
• Flash point: 185.374°C (Cal.)
• Refractive index: 1.645 (Cal.)