2-Methyl-3-(4-Methylphenyl)-5,6,7,8-Tetrahydro-[1]Benzothiolo[3,2-e]Pyrimidin-4-One
[CAS# 34387-07-0]

Identification

• Name: 2-Methyl-3-(4-Methylphenyl)-5,6,7,8-Tetrahydro-[1]Benzothiolo[3,2-e]Pyrimidin-4-One
• Synonyms: 2-Methyl-3-(4-Methylphenyl)-5,6,7,8-Tetrahydrobenzothiopheno[3,2-E]Pyrimidin-4-One; (1)Benzothieno(2,3-D)Pyrimidin-4-One, 5,6,7,8-Tetrahydro-2-Methyl-3-(P-Tolyl)-; 2-Methyl-4-Oxo-3-(P-Tolyl)-5,6-Tetramethylenethieno(2,3-D)Pyrimidine
• Molecular Formula: C₁₈H₁₈N₂OS
• Molecular Weight: 310.41
• CAS Registry Number: 34387-07-0
• SMILES: C4=C(N3C(=O)C1=C(SC2=C1CCCC2)N=C3C)C=CC(=C4)C
• InChI: 1S/C18H18N2OS/c1-11-7-9-13(10-8-11)20-12(2)19-17-16(18(20)21)14-5-3-4-6-15(14)22-17/h7-10H,3-6H2,1-2H3
• InChIKey: YRWWUTIFTAESJM-UHFFFAOYSA-N

Properties

• Density: 1.327g/cm³ (Cal.)
• Boiling point: 524.551°C at 760 mmHg (Cal.)
• Flash point: 271.039°C (Cal.)