2-(3,4,5-Trimethoxyphenyl)-1,3-Perhydrothiazine-4-One
[CAS# 82697-76-5]

Identification

• Name: 2-(3,4,5-Trimethoxyphenyl)-1,3-Perhydrothiazine-4-One
• Synonyms: 2-(3,4,5-Trimethoxyphenyl)-1,3-Perhydrothiazine-4-One; 4H-1,3-Thiazin-4-One, Tetrahydro-2-(3,4,5-Trimethoxyphenyl)-; Tetrahydro-2-(3,4,5-Trimethoxyphenyl)-4H-1,3-Thiazin-4-One
• Molecular Formula: C₁₃H₁₇NO₄S
• Molecular Weight: 283.34
• CAS Registry Number: 82697-76-5
• SMILES: C1=C(C(=C(C=C1C2SCCC(N2)=O)OC)OC)OC
• InChI: 1S/C13H17NO4S/c1-16-9-6-8(7-10(17-2)12(9)18-3)13-14-11(15)4-5-19-13/h6-7,13H,4-5H2,1-3H3,(H,14,15)
• InChIKey: RNZPUDNTBZUVDK-UHFFFAOYSA-N

Properties

• Density: 1.207g/cm³ (Cal.)
• Boiling point: 490.834°C at 760 mmHg (Cal.)
• Flash point: 250.647°C (Cal.)