2-(2-Phenylsulfonylethylsulfanyl)Pyridine-3-Carboxylate
[CAS# 175203-21-1]

Identification

• Name: 2-(2-Phenylsulfonylethylsulfanyl)Pyridine-3-Carboxylate
• Synonyms: 2-(2-Phenylsulfonylethylthio)-3-Pyridinecarboxylate; 2-(2-Phenylsulfonylethylthio)Nicotinate; Zinc00149981
• Molecular Formula: C₁₄H₁₂NO₄S₂
• Molecular Weight: 322.37
• CAS Registry Number: 175203-21-1
• SMILES: C2=C([S](=O)(=O)CCSC1=C(C=CC=N1)C([O-])=O)C=CC=C2
• InChI: 1S/C14H13NO4S2/c16-14(17)12-7-4-8-15-13(12)20-9-10-21(18,19)11-5-2-1-3-6-11/h1-8H,9-10H2,(H,16,17)/p-1
• InChIKey: LYXDTDBDUWKOQF-UHFFFAOYSA-M

Properties

• Boiling point: 580.473°C at 760 mmHg (Cal.)
• Flash point: 304.859°C (Cal.)