2-[2-(1-Pyrrolidinyl)ethyl]-1,2-benzothiazol-3(2H)-one
[CAS# 69577-10-2]

Identification

• Name: 2-[2-(1-Pyrrolidinyl)ethyl]-1,2-benzothiazol-3(2H)-one
• Synonyms: 2-(2-Pyrrolidin-1-yl-ethyl)-benzo[d]isothiazol-3-one; 2-[2-(1-pyrrolidinyl)ethyl]-1,2-benzisothiazol-3(2H)-one
• Molecular Formula: C₁₃H₁₆N₂OS
• Molecular Weight: 248.34
• CAS Registry Number: 69577-10-2
• EINECS: 274-049-3
• SMILES: C1CCN(C1)CCN2C(=O)C3=CC=CC=C3S2
• InChI: 1S/C13H16N2OS/c16-13-11-5-1-2-6-12(11)17-15(13)10-9-14-7-3-4-8-14/h1-2,5-6H,3-4,7-10H2
• InChIKey: UOWPTFYGZGEOLW-UHFFFAOYSA-N

Properties

• Density: 1.2±0.1g/cm³ (Cal.)
• Boiling point: 402.8±47.0°C at 760 mmHg (Cal.)
• Flash point: 197.4±29.3°C (Cal.)