(3E)-3-[[3-[(3,4-Dichlorophenyl)Sulfanylmethyl]-5-Ethoxy-4-Hydroxyphenyl]Methylidene]Oxolan-2-One
[CAS# 107788-13-6]

Identification

• Name: (3E)-3-[[3-[(3,4-Dichlorophenyl)Sulfanylmethyl]-5-Ethoxy-4-Hydroxyphenyl]Methylidene]Oxolan-2-One
• Synonyms: (3E)-3-[[3-[(3,4-Dichlorophenyl)Sulfanylmethyl]-5-Ethoxy-4-Hydroxy-Phenyl]Methylene]Tetrahydrofuran-2-One; (3E)-3-[[3-[[(3,4-Dichlorophenyl)Thio]Methyl]-5-Ethoxy-4-Hydroxyphenyl]Methylene]-2-Tetrahydrofuranone; (3E)-3-[3-[[(3,4-Dichlorophenyl)Thio]Methyl]-5-Ethoxy-4-Hydroxy-Benzylidene]Tetrahydrofuran-2-One
• Molecular Formula: C₂₀H₁₈Cl₂O₄S
• Molecular Weight: 425.33
• CAS Registry Number: 107788-13-6
• SMILES: C1=C(C(=C(C=C1\C=C/2C(OCC2)=O)OCC)O)CSC3=CC=C(C(=C3)Cl)Cl
• InChI: 1S/C20H18Cl2O4S/c1-2-25-18-9-12(7-13-5-6-26-20(13)24)8-14(19(18)23)11-27-15-3-4-16(21)17(22)10-15/h3-4,7-10,23H,2,5-6,11H2,1H3/b13-7+
• InChIKey: NKOHPYYSZLSIFD-NTUHNPAUSA-N

Properties

• Density: 1.436g/cm³ (Cal.)
• Boiling point: 621.418°C at 760 mmHg (Cal.)
• Flash point: 329.622°C (Cal.)