3-Ethyl-6-Methyl-2-Thioxo-2,3-Dihydro[1,3]Thiazolo[4,5-d]Pyrimidin-7(6H)-One
[CAS# 440111-63-7]

Identification

• Name: 3-Ethyl-6-Methyl-2-Thioxo-2,3-Dihydro[1,3]Thiazolo[4,5-d]Pyrimidin-7(6H)-One
• Synonyms: 3-Ethyl-6-methyl-2-thioxo-2,3-dihydro[1,3]thiazolo[4,5-d]pyrimidin-7(6H)-one #; 3-Ethyl-6-methyl-2-thioxo-2,3-dihydrothiazolo[4,5-d]pyrimidin-7(6H)-one; 3-ethyl-6-methyl-2-thioxo-6-hydro-1,3-thiazolino[4,5-d]pyrimidin-7-one
• Molecular Formula: C₈H₉N₃OS₂
• Molecular Weight: 227.31
• CAS Registry Number: 440111-63-7
• SMILES: O=C1C=2SC(=S)N(C=2/N=C\N1C)CC
• InChI: 1S/C8H9N3OS2/c1-3-11-6-5(14-8(11)13)7(12)10(2)4-9-6/h4H,3H2,1-2H3
• InChIKey: DXNXBAYYHWPHEJ-UHFFFAOYSA-N

Properties

• Density: 1.522g/cm³ (Cal.)
• Boiling point: 321.267°C at 760 mmHg (Cal.)
• Flash point: 148.097°C (Cal.)
• Refractive index: 1.751 (Cal.)