2-Hydroxy-3-Isopropyl-2,4,6-Cycloheptatrien-1-One
[CAS# 285992-14-5]

Identification

• Name: 2-Hydroxy-3-Isopropyl-2,4,6-Cycloheptatrien-1-One
• Synonyms: 2,4,6-Cycloheptatrien-1-one, 2-hydroxy-3-(1-methylethyl)-; 2-hydroxy-7-isopropylcyclohepta-2,4,6-trienone; Hinokitiol
• Molecular Formula: C₁₀H₁₂O₂
• Molecular Weight: 164.20
• CAS Registry Number: 285992-14-5
• SMILES: CC(C)C1=C(C(=O)C=CC=C1)O
• InChI: 1S/C10H12O2/c1-7(2)8-5-3-4-6-9(11)10(8)12/h3-7H,1-2H3,(H,11,12)
• InChIKey: TUFYVOCKVJOUIR-UHFFFAOYSA-N

Properties

• Density: 1.1±0.1g/cm³ (Cal.)
• Boiling point: 302.8±35.0°C at 760 mmHg (Cal.)
• Flash point: 127.9±18.5°C (Cal.)
• Refractive index: 1.554 (Cal.)