3-[(4-Methylsulfonylphenyl)Methylidene]Pentane-2,4-Dione
[CAS# 137109-78-5]

Identification

• Name: 3-[(4-Methylsulfonylphenyl)Methylidene]Pentane-2,4-Dione
• Synonyms: 3-[(4-Methylsulfonylphenyl)Methylene]Pentane-2,4-Dione; 3-(4-Mesylbenzylidene)Pentane-2,4-Dione; Or-1384
• Molecular Formula: C₁₃H₁₄O₄S
• Molecular Weight: 266.31
• CAS Registry Number: 137109-78-5
• SMILES: C1=C([S](=O)(=O)C)C=CC(=C1)C=C(C(=O)C)C(=O)C
• InChI: 1S/C13H14O4S/c1-9(14)13(10(2)15)8-11-4-6-12(7-5-11)18(3,16)17/h4-8H,1-3H3
• InChIKey: CAWYWWPWSAMGBV-UHFFFAOYSA-N

Properties

• Density: 1.234g/cm³ (Cal.)
• Boiling point: 525.321°C at 760 mmHg (Cal.)
• Flash point: 351.788°C (Cal.)