3-Ethyl-5-(2-Methyl-2-Propanyl)-3,6-Dihydro-2H-1,3,4-Thiadiazin-2-One
[CAS# 531495-80-4]

Identification

• Name: 3-Ethyl-5-(2-Methyl-2-Propanyl)-3,6-Dihydro-2H-1,3,4-Thiadiazin-2-One
• Synonyms: 5-(tert-butyl)-3-ethyl-3,6-dihydro-2H-1,3,4-thiadiazin-2-one
• Molecular Formula: C₉H₁₆N₂OS
• Molecular Weight: 200.30
• CAS Registry Number: 531495-80-4
• SMILES: CCN1C(=O)SCC(=N1)C(C)(C)C
• InChI: 1S/C9H16N2OS/c1-5-11-8(12)13-6-7(10-11)9(2,3)4/h5-6H2,1-4H3
• InChIKey: BCSHZANEICAYFZ-UHFFFAOYSA-N

Properties

• Density: 1.125g/cm³ (Cal.)
• Boiling point: 269.388°C at 760 mmHg (Cal.)
• Flash point: 116.722°C (Cal.)
• Refractive index: 1.552 (Cal.)