Methyl 2-Thioxo-2,3-Dihydro-1,3-Benzothiazole-5-Carboxylate
[CAS# 58759-67-4]

Identification

• Name: Methyl 2-Thioxo-2,3-Dihydro-1,3-Benzothiazole-5-Carboxylate
• Synonyms: methyl 2-thioxo-2,3-dihydrobenzo[d]thiazole-5-carboxylate
• Molecular Formula: C₉H₇NO₂S₂
• Molecular Weight: 225.29
• CAS Registry Number: 58759-67-4
• SMILES: COC(=O)c1cc2nc(S)sc2cc1
• InChI: 1S/C9H7NO2S2/c1-12-8(11)5-2-3-7-6(4-5)10-9(13)14-7/h2-4H,1H3,(H,10,13)
• InChIKey: RODLEVQAZWKRIQ-UHFFFAOYSA-N

Properties

• Density: 1.437g/cm³ (Cal.)
• Boiling point: 356.575°C at 760 mmHg (Cal.)
• Flash point: 169.451°C (Cal.)