5-(1,3-Benzothiazol-2-Yl)Pentanoic Acid
[CAS# 21224-20-4]

Identification

• Name: 5-(1,3-Benzothiazol-2-Yl)Pentanoic Acid
• Synonyms: 5-(1,3-Benzothiazol-2-Yl)Valerate; Zinc02359281
• Molecular Formula: C₁₂H₁₂NO₂S
• Molecular Weight: 234.29
• CAS Registry Number: 21224-20-4
• SMILES: C2=C1SC(=NC1=CC=C2)CCCCC([O-])=O
• InChI: 1S/C12H13NO2S/c14-12(15)8-4-3-7-11-13-9-5-1-2-6-10(9)16-11/h1-2,5-6H,3-4,7-8H2,(H,14,15)/p-1
• InChIKey: HHBVTXVPGVQCOD-UHFFFAOYSA-M

Properties

• Boiling point: 418.253°C at 760 mmHg (Cal.)
• Flash point: 206.752°C (Cal.)