(5E)-5-[4-(Methylsulfanyl)Benzylidene]-2-Sulfanyl-1,3-Thiazol-4(5H)-One
[CAS# 127378-28-3]

Identification

• Name: (5E)-5-[4-(Methylsulfanyl)Benzylidene]-2-Sulfanyl-1,3-Thiazol-4(5H)-One
• Synonyms: (5E)-2-Mercapto-5-[4-(methylthio)benzylidene]-1,3-thiazol-4(5H)-one; (5E)-5-[4-(methylsulfanyl)benzylidene]-2-thioxo-1,3-thiazolidin-4-one; 5-[4-(methylsulfanyl)benzylidene]-2-thioxo-1,3-thiazolidin-4-one
• Molecular Formula: C₁₁H₉NOS₃
• Molecular Weight: 267.39
• CAS Registry Number: 127378-28-3
• SMILES: CSC1=CC=C(C=C1)/C=C/2\C(=O)N=C(S2)S
• InChI: 1S/C11H9NOS3/c1-15-8-4-2-7(3-5-8)6-9-10(13)12-11(14)16-9/h2-6H,1H3,(H,12,13,14)/b9-6+
• InChIKey: SEIFTQHMDCKSIB-RMKNXTFCSA-N

Properties

• Density: 1.4±0.1g/cm³ (Cal.)
• Melting point: 265-267°C (Expl.)
• Boiling point: 432.3±55.0°C at 760 mmHg (Cal.)
• Flash point: 215.3±31.5°C (Cal.)
• Refractive index: 1.71 (Cal.)

Safety Data

• Safety Description: IRRITANT