3-{[5-(4-Pyridinyl)-1,3,4-oxadiazol-2-yl]sulfanyl}propanoic acid
[CAS# 604740-20-7]

Identification

• Name: 3-{[5-(4-Pyridinyl)-1,3,4-oxadiazol-2-yl]sulfanyl}propanoic acid
• Synonyms: 3-(5-Pyridin-4-yl-[1,3,4]oxadiazol-2-ylsulfanyl)-propionic acid; 3-{[5-(4-pyridinyl)-1,3,4-oxadiazol-2-yl]sulfanyl}propanoic acid; 3-{[5-(4-pyridinyl)-1,3,4-oxadiazol-2-yl]thio}propanoic acid
• Molecular Formula: C₁₀H₉N₃O₃S
• Molecular Weight: 251.26
• CAS Registry Number: 604740-20-7
• SMILES: O=C(O)CCSc1nnc(o1)c2ccncc2
• InChI: 1S/C10H9N3O3S/c14-8(15)3-6-17-10-13-12-9(16-10)7-1-4-11-5-2-7/h1-2,4-5H,3,6H2,(H,14,15)
• InChIKey: HSRJAFMGXXALCQ-UHFFFAOYSA-N

Properties

• Density: 1.489g/cm³ (Cal.)
• Boiling point: 513.013°C at 760 mmHg (Cal.)
• Flash point: 264.061°C (Cal.)
• Refractive index: 1.641 (Cal.)