2-[(2E)-2-Buten-1-ylsulfanyl]-1,3-benzothiazole
[CAS# 89805-98-1]

Identification

• Name: 2-[(2E)-2-Buten-1-ylsulfanyl]-1,3-benzothiazole
• Synonyms: (E)-2-(but-2-en-1-ylthio)benzo[d]thiazole
• Molecular Formula: C₁₁H₁₁NS₂
• Molecular Weight: 221.34
• CAS Registry Number: 89805-98-1
• SMILES: C\C=C\CSc1nc2ccccc2s1
• InChI: 1S/C11H11NS2/c1-2-3-8-13-11-12-9-6-4-5-7-10(9)14-11/h2-7H,8H2,1H3/b3-2+
• InChIKey: XUMHHDLGNBREGC-NSCUHMNNSA-N

Properties

• Density: 1.229g/cm³ (Cal.)
• Boiling point: 331.531°C at 760 mmHg (Cal.)
• Flash point: 154.305°C (Cal.)