(5E)-5-(Mesitylmethylene)-2-Sulfanyl-1,3-Thiazol-4(5H)-One
[CAS# 153567-97-6]

Identification

• Name: (5E)-5-(Mesitylmethylene)-2-Sulfanyl-1,3-Thiazol-4(5H)-One
• Synonyms: (5E)-2-Mercapto-5-(mesitylmethylene)-1,3-thiazol-4(5H)-one; MFCD04969054; ZINC01203759
• Molecular Formula: C₁₃H₁₃NOS₂
• Molecular Weight: 263.38
• CAS Registry Number: 153567-97-6
• SMILES: CC1=CC(=C(C(=C1)C)/C=C/2\C(=O)N=C(S2)S)C
• InChI: 1S/C13H13NOS2/c1-7-4-8(2)10(9(3)5-7)6-11-12(15)14-13(16)17-11/h4-6H,1-3H3,(H,14,15,16)/b11-6+
• InChIKey: JHAHQBBMMGFVIS-IZZDOVSWSA-N

Properties

• Density: 1.3±0.1g/cm³ (Cal.)
• Boiling point: 392.9±52.0°C at 760 mmHg (Cal.)
• Flash point: 191.4±30.7°C (Cal.)
• Refractive index: 1.652 (Cal.)

Safety Data

• Safety Description: IRRITANT