2-Mercapto-4-Methylpyrimidine
[CAS# 35071-17-1]

Identification

• Name: 2-Mercapto-4-Methylpyrimidine
• Synonyms: 2(1H)-Pyrimidinethione, 4-Methyl-; 2-Mercapto-4-Methylpyrimidine; 4-Methyl-2(1H)-Pyrimidinethione
• Molecular Formula: C₅H₆N₂S
• Molecular Weight: 126.18
• CAS Registry Number: 35071-17-1
• SMILES: CC1=CC=NC(=S)N1
• InChI: 1S/C5H6N2S/c1-4-2-3-6-5(8)7-4/h2-3H,1H3,(H,6,7,8)
• InChIKey: BVPHXTUEZOQIBS-UHFFFAOYSA-N

Properties

• Density: 1.245g/cm³ (Cal.)
• Boiling point: 201.675°C at 760 mmHg (Cal.)
• Flash point: 75.771°C (Cal.)

References

• (1): Ghada J. CorbanPresent address: Inorganic Chemistry Laboratory, Department of Chemistry, College of Science, UAE University, 17551, Al Ain, United Arab Emirates., Sotiris K. Hadjikakou, Athanasios C. Tsipis, Maciej Kubicki, T. Bakas and Nick Hadjiliadis. Inhibition of peroxidase-catalyzed iodination by thioamides: experimental and theoretical study of the antithyroid activity of thioamides, New J. Chem., 2011, 35, 213.