2-[(4-Methylphenyl)Thio]-3-Pyridinecarboxylicacid
[CAS# 955-53-3]

Identification

• Name: 2-[(4-Methylphenyl)Thio]-3-Pyridinecarboxylicacid
• Synonyms: 2-[(4-Methylphenyl)Thio]-3-Pyridinecarboxylate; 2-[(4-Methylphenyl)Thio]Nicotinate; Zinc00131927
• Molecular Formula: C₁₃H₁₀NO₂S
• Molecular Weight: 244.29
• CAS Registry Number: 955-53-3
• SMILES: C1=CC(=CC=C1C)SC2=NC=CC=C2C(=O)[O-]
• InChI: 1S/C13H11NO2S/c1-9-4-6-10(7-5-9)17-12-11(13(15)16)3-2-8-14-12/h2-8H,1H3,(H,15,16)/p-1
• InChIKey: VEZNUKVMXCLWMM-UHFFFAOYSA-M

Properties

• Boiling point: 422.779°C at 760 mmHg (Cal.)
• Flash point: 209.489°C (Cal.)