ChemSpider 2D Image | 2-(3-Hydro-1-phenyl-propyl)-4-methyl-phenol | C16H20O

2-(3-Hydro-1-phenyl-propyl)-4-methyl-phenol

  • Molecular FormulaC16H20O
  • Average mass228.329 Da
  • Monoisotopic mass228.151413 Da
  • ChemSpider ID22498931

More details:

Validated by Experts, Validated by Users, Non-Validated, Removed by Users

2-(3-Hydro-1-phenyl-propyl)-4-methyl-phenol
2-[1-(1,5-Cyclohexadien-1-yl)propyl]-4-methylphenol [ACD/IUPAC Name]
2-[1-(1,5-Cyclohexadien-1-yl)propyl]-4-methylphenol [German] [ACD/IUPAC Name]
2-[1-(1,5-Cyclohexadién-1-yl)propyl]-4-méthylphénol [French] [ACD/IUPAC Name]
2-[1-(Cyclohexa-1,5-dien-1-yl)propyl]-4-methylphenol
Phenol, 2-[1-(1,5-cyclohexadien-1-yl)propyl]-4-methyl- [ACD/Index Name]
851789-43-0 [RN]
MFCD11100714 [MDL number]

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

Density: 1.0±0.1 g/cm3
Boiling Point: 354.7±21.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.8 mmHg at 25°C
Enthalpy of Vaporization: 62.3±3.0 kJ/mol
Flash Point: 159.9±11.7 °C
Index of Refraction: 1.575
Molar Refractivity: 72.0±0.3 cm3
#H bond acceptors: 1
#H bond donors: 1
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 1
ACD/LogP: 5.14
ACD/LogD (pH 5.5): 4.61
ACD/BCF (pH 5.5): 1883.80
ACD/KOC (pH 5.5): 7688.91
ACD/LogD (pH 7.4): 4.61
ACD/BCF (pH 7.4): 1881.82
ACD/KOC (pH 7.4): 7680.83
Polar Surface Area: 20 Å2
Polarizability: 28.5±0.5 10-24cm3
Surface Tension: 43.0±3.0 dyne/cm
Molar Volume: 217.8±3.0 cm3

Click to predict properties on the Chemicalize site


Advertisement