6-(Phenylsulfanyl)Nicotinonitrile
[CAS# 259683-21-1]

Identification

• Name: 6-(Phenylsulfanyl)Nicotinonitrile
• Synonyms: 2-(Phenylthio)pyridine-5-carbonitrile; MFCD00832837; Maybridge3_006380
• Molecular Formula: C₁₂H₈N₂S
• Molecular Weight: 212.27
• CAS Registry Number: 259683-21-1
• SMILES: N#Cc2cnc(Sc1ccccc1)cc2
• InChI: 1S/C12H8N2S/c13-8-10-6-7-12(14-9-10)15-11-4-2-1-3-5-11/h1-7,9H
• InChIKey: JSDVHTWWMQBBRE-UHFFFAOYSA-N

Properties

• Density: 1.269g/cm³ (Cal.)
• Melting point: 96-98°C (Expl.)
• Boiling point: 400.472°C at 760 mmHg (Cal.)
• Flash point: 195.999°C (Cal.)
• Refractive index: 1.661 (Cal.)

Safety Data

• Safety Description: Irritant