1-(3,4-Dihydroxyphenyl)-2-[(4,6-Dimethyl-2-Pyrimidinyl)Sulfanyl]Ethanone
[CAS# 430447-82-8]

Identification

• Name: 1-(3,4-Dihydroxyphenyl)-2-[(4,6-Dimethyl-2-Pyrimidinyl)Sulfanyl]Ethanone
• Synonyms: 1-(3,4-dihydroxyphenyl)-2-[(4,6-dimethyl-2-pyrimidinyl)sulfanyl]ethanone; 1-(3,4-dihydroxyphenyl)-2-[(4,6-dimethyl-2-pyrimidinyl)thio]ethanone; 1-(3,4-dihydroxyphenyl)-2-[(4,6-dimethylpyrimidin-2-yl)sulfanyl]ethan-1-one
• Molecular Formula: C₁₄H₁₄N₂O₃S
• Molecular Weight: 290.34
• CAS Registry Number: 430447-82-8
• SMILES: CC1=CC(=NC(=N1)SCC(=O)C2=CC(=C(C=C2)O)O)C
• InChI: 1S/C14H14N2O3S/c1-8-5-9(2)16-14(15-8)20-7-13(19)10-3-4-11(17)12(18)6-10/h3-6,17-18H,7H2,1-2H3
• InChIKey: JQXFBAGVXOGSNK-UHFFFAOYSA-N

Properties

• Density: 1.4±0.1g/cm³ (Cal.)
• Boiling point: 561.6±50.0°C at 760 mmHg (Cal.)
• Flash point: 293.5±30.1°C (Cal.)
• Refractive index: 1.669 (Cal.)