5-(4-Chloro-Phenyl)-[1,3,4]Oxadiazol-2-Ylsulfanyl]-Acetic Acid
[CAS# 49809-28-1]

Identification

• Name: 5-(4-Chloro-Phenyl)-[1,3,4]Oxadiazol-2-Ylsulfanyl]-Acetic Acid
• Synonyms: 2-[[5-(4-Chlorophenyl)-1,3,4-Oxadiazol-2-Yl]Thio]Acetate; 2-[[5-(4-Chlorophenyl)-1,3,4-Oxadiazol-2-Yl]Sulfanyl]Ethanoate; Zinc03886121
• Molecular Formula: C₁₀H₆ClN₂O₃S
• Molecular Weight: 269.68
• CAS Registry Number: 49809-28-1
• SMILES: C2=C(C1=NN=C(SCC([O-])=O)O1)C=CC(=C2)Cl
• InChI: 1S/C10H7ClN2O3S/c11-7-3-1-6(2-4-7)9-12-13-10(16-9)17-5-8(14)15/h1-4H,5H2,(H,14,15)/p-1
• InChIKey: URXRQPSQQUXGHW-UHFFFAOYSA-M

Properties

• Boiling point: 473.25°C at 760 mmHg (Cal.)
• Flash point: 240.013°C (Cal.)