(5E)-5-(4-Isobutoxybenzylidene)-2-Sulfanyl-1,3-Thiazol-4(5H)-One
[CAS# 164520-75-6]

Identification

• Name: (5E)-5-(4-Isobutoxybenzylidene)-2-Sulfanyl-1,3-Thiazol-4(5H)-One
• Synonyms: (5E)-5-(4-Isobutoxybenzylidene)-2-mercapto-1,3-thiazol-4(5H)-one; 5-{[4-(2-methylpropoxy)phenyl]methylene}-2-thioxo-1,3-thiazolidin-4-one; A1829/0077161
• Molecular Formula: C₁₄H₁₅NO₂S₂
• Molecular Weight: 293.40
• CAS Registry Number: 164520-75-6
• SMILES: CC(C)COC1=CC=C(C=C1)/C=C/2\C(=O)N=C(S2)S
• InChI: 1S/C14H15NO2S2/c1-9(2)8-17-11-5-3-10(4-6-11)7-12-13(16)15-14(18)19-12/h3-7,9H,8H2,1-2H3,(H,15,16,18)/b12-7+
• InChIKey: CSQOGPWVIWZOOG-KPKJPENVSA-N

Properties

• Density: 1.3±0.1g/cm³ (Cal.)
• Boiling point: 438.1±55.0°C at 760 mmHg (Cal.)
• Flash point: 218.7±31.5°C (Cal.)
• Refractive index: 1.629 (Cal.)

Safety Data

• Safety Description: IRRITANT