5-Benzyl-2-mercapto-6-methylpyrimidin-4-ol

CAS: 36361-79-2

Ref. 3D-FB116435

Product Information

• Name: 5-Benzyl-2-mercapto-6-methylpyrimidin-4-ol

Description

5-Benzyl-2-mercapto-6-methylpyrimidin-4-ol is a pyrimidine that has a molecular formula of C8H9N3O2S. It has a centrosymmetric structure with the molecules in chains and dihedral angles. The molecule also has hydrogen bonds that are present in the structure. 5-Benzyl-2-mercapto-6-methylpyrimidin-4-ol is not soluble in water but can be dissolved in ethanol or methanol. This compound is used as an intermediate for other compounds, such as benzyl mercaptopurine and benzyl mercaptopyrimidine.

• Brand: Biosynth

Chemical properties

• Molecular weight: 232.3 g/mol
• Formula: C₁₂H₁₂N₂OS
• Purity: Min. 95%
• InChI: InChI=1S/C12H12N2OS/c1-8-10(11(15)14-12(16)13-8)7-9-5-3-2-4-6-9/h2-6H,7H2,1H3,(H2,13,14,15,16)
• InChI key: InChIKey=DNEXCHUDIUXJAZ-UHFFFAOYSA-N
• SMILES: Cc1[nH]c(=S)[nH]c(=O)c1Cc1ccccc1