Methyl 2-Thioxo-2,3-Dihydro-1,3-Benzothiazole-6-Carboxylate
[CAS# 162959-43-5]

Identification

• Name: Methyl 2-Thioxo-2,3-Dihydro-1,3-Benzothiazole-6-Carboxylate
• Synonyms: methyl 2-thioxo-2,3-dihydrobenzo[d]thiazole-6-carboxylate
• Molecular Formula: C₉H₇NO₂S₂
• Molecular Weight: 225.29
• CAS Registry Number: 162959-43-5
• SMILES: COC(=O)c1ccc2c(c1)sc(=S)[nH]2
• InChI: 1S/C9H7NO2S2/c1-12-8(11)5-2-3-6-7(4-5)14-9(13)10-6/h2-4H,1H3,(H,10,13)
• InChIKey: RXRSMJKKNDSXJM-UHFFFAOYSA-N

Properties

• Density: 1.5g/cm³ (Cal.)
• Boiling point: 388.067°C at 760 mmHg (Cal.)
• Flash point: 188.496°C (Cal.)
• Refractive index: 1.718 (Cal.)