4-Methyl-1,5-Benzothiazepin-2(3H)-One
[CAS# 63870-01-9]

Identification

• Name: 4-Methyl-1,5-Benzothiazepin-2(3H)-One
• Synonyms: 1,5-Benzothiazepin-2(3H)-One, 4-Methyl-; 4-Methyl-1,5-Benzothiazepin-2(3H)-One; Brn 0135500
• Molecular Formula: C₁₀H₉NOS
• Molecular Weight: 191.25
• CAS Registry Number: 63870-01-9
• SMILES: C2=C1SC(=O)CC(=NC1=CC=C2)C
• InChI: 1S/C10H9NOS/c1-7-6-10(12)13-9-5-3-2-4-8(9)11-7/h2-5H,6H2,1H3
• InChIKey: CSWLHQJEBGLHMJ-UHFFFAOYSA-N

Properties

• Density: 1.257g/cm³ (Cal.)
• Boiling point: 306.799°C at 760 mmHg (Cal.)
• Flash point: 139.348°C (Cal.)