2-Chloro-1-(2,4,6-cycloheptatrien-1-yl)ethanone
[CAS# 98405-71-1]

Identification

• Name: 2-Chloro-1-(2,4,6-cycloheptatrien-1-yl)ethanone
• Synonyms: 2-chloro-1-(cyclohepta-2,4,6-trien-1-yl)ethanone
• Molecular Formula: C₉H₉ClO
• Molecular Weight: 168.62
• CAS Registry Number: 98405-71-1
• SMILES: C1=CC=CC(C=C1)C(=O)CCl
• InChI: 1S/C9H9ClO/c10-7-9(11)8-5-3-1-2-4-6-8/h1-6,8H,7H2
• InChIKey: KTZKQWOHWVWWLG-UHFFFAOYSA-N

Properties

• Density: 1.149g/cm³ (Cal.)
• Boiling point: 266.446°C at 760 mmHg (Cal.)
• Flash point: 128.217°C (Cal.)