Methyl 2-Thioxo-2,3-Dihydro-1,3-Benzothiazole-7-Carboxylate
[CAS# 113071-96-8]

Identification

• Name: Methyl 2-Thioxo-2,3-Dihydro-1,3-Benzothiazole-7-Carboxylate
• Synonyms: methyl 2-thioxo-2,3-dihydrobenzo[d]thiazole-7-carboxylate
• Molecular Formula: C₉H₇NO₂S₂
• Molecular Weight: 225.29
• CAS Registry Number: 113071-96-8
• SMILES: COC(=O)c1cccc2c1sc(=S)[nH]2
• InChI: 1S/C9H7NO2S2/c1-12-8(11)5-3-2-4-6-7(5)14-9(13)10-6/h2-4H,1H3,(H,10,13)
• InChIKey: AMCGHLNXBNKYRO-UHFFFAOYSA-N

Properties

• Density: 1.5g/cm³ (Cal.)
• Boiling point: 377.259°C at 760 mmHg (Cal.)
• Flash point: 181.96°C (Cal.)
• Refractive index: 1.718 (Cal.)