2-Chloro-3-Hydroxy-2,4,6-Cycloheptatrien-1-One
[CAS# 100949-20-0]

Identification

• Name: 2-Chloro-3-Hydroxy-2,4,6-Cycloheptatrien-1-One
• Synonyms: 2-chloro-3-hydroxycyclohepta-2,4,6-trienone
• Molecular Formula: C₇H₅ClO₂
• Molecular Weight: 156.57
• CAS Registry Number: 100949-20-0
• SMILES: c1ccc(=O)c(c(c1)O)Cl
• InChI: 1S/C7H5ClO2/c8-7-5(9)3-1-2-4-6(7)10/h1-4,9H
• InChIKey: DPXIANFDMBDSPS-UHFFFAOYSA-N

Properties

• Density: 1.401g/cm³ (Cal.)
• Boiling point: 244.679°C at 760 mmHg (Cal.)
• Flash point: 101.778°C (Cal.)
• Refractive index: 1.599 (Cal.)