3-(2-Pyridinylsulfanyl)-2,4-pentanedione
[CAS# 67302-31-2]

Identification

• Name: 3-(2-Pyridinylsulfanyl)-2,4-pentanedione
• Synonyms: 3-(PYRID-2-YLTHIO)PENTANE-2,4-DIONE
• Molecular Formula: C₁₀H₁₁NO₂S
• Molecular Weight: 209.26
• CAS Registry Number: 67302-31-2
• SMILES: CC(=O)C(Sc1ccccn1)C(C)=O
• InChI: 1S/C10H11NO2S/c1-7(12)10(8(2)13)14-9-5-3-4-6-11-9/h3-6,10H,1-2H3
• InChIKey: XPLMQBAWWHRDNP-UHFFFAOYSA-N

Properties

• Density: 1.202g/cm³ (Cal.)
• Boiling point: 320.095°C at 760 mmHg (Cal.)
• Flash point: 147.388°C (Cal.)