3-Benzyl-6-Chloro-2-Pyrone
[CAS# 85533-80-8]

Identification

• Name: 3-Benzyl-6-Chloro-2-Pyrone
• Synonyms: 6-Chloro-3-(Phenylmethyl)-2-Pyranone; 3-(Benzyl)-6-Chloro-Pyran-2-One; 2H-Pyran-2-One, 6-Chloro-3-(Phenylmethyl)-
• Molecular Formula: C₁₂H₉ClO₂
• Molecular Weight: 220.65
• CAS Registry Number: 85533-80-8
• SMILES: C1=CC=CC=C1CC2=CC=C(OC2=O)Cl
• InChI: 1S/C12H9ClO2/c13-11-7-6-10(12(14)15-11)8-9-4-2-1-3-5-9/h1-7H,8H2
• InChIKey: XHTCTUGLQUCSFJ-UHFFFAOYSA-N

Properties

• Density: 1.289g/cm³ (Cal.)
• Boiling point: 372.511°C at 760 mmHg (Cal.)
• Flash point: 199.308°C (Cal.)