6-Methylsulfanyl-3H-Pyrimidin-4-One
[CAS# 30001-45-7]

Identification

• Name: 6-Methylsulfanyl-3H-Pyrimidin-4-One
• Synonyms: 6-(Methylthio)-3H-Pyrimidin-4-One; Nsc43266
• Molecular Formula: C₅H₆N₂OS
• Molecular Weight: 142.18
• CAS Registry Number: 30001-45-7
• SMILES: CSC1=CC(=O)NC=N1
• InChI: 1S/C5H6N2OS/c1-9-5-2-4(8)6-3-7-5/h2-3H,1H3,(H,6,7,8)
• InChIKey: BTIAVKOUWHGNFD-UHFFFAOYSA-N

Properties

• Density: 1.359g/cm³ (Cal.)
• Boiling point: 311.3°C at 760 mmHg (Cal.)
• Flash point: 142.1°C (Cal.)