2-[2-(4-Chlorophenyl)-1,3-Benzothiazol-5-Yl]Acetic Acid
[CAS# 36782-49-7]

Identification

• Name: 2-[2-(4-Chlorophenyl)-1,3-Benzothiazol-5-Yl]Acetic Acid
• Synonyms: 2-[2-(4-Chlorophenyl)-1,3-Benzothiazol-5-Yl]Ethanoic Acid; 2-(4-Chlorophenyl)-5-Benzothiazoleacetic Acid; 5-Benzothiazoleacetic Acid, 2-(4-Chlorophenyl)-
• Molecular Formula: C₁₅H₁₀ClNO₂S
• Molecular Weight: 303.76
• CAS Registry Number: 36782-49-7
• SMILES: C1=CC(=CC2=C1SC(=N2)C3=CC=C(C=C3)Cl)CC(O)=O
• InChI: 1S/C15H10ClNO2S/c16-11-4-2-10(3-5-11)15-17-12-7-9(8-14(18)19)1-6-13(12)20-15/h1-7H,8H2,(H,18,19)
• InChIKey: FJGLVTYWNCZPBL-UHFFFAOYSA-N

Properties

• Density: 1.44g/cm³ (Cal.)
• Boiling point: 505.518°C at 760 mmHg (Cal.)
• Flash point: 259.528°C (Cal.)