ChemSpider 2D Image | 2-Methyl-1-[2-(methylsulfanyl)phenyl]-2-propanol | C11H16OS

2-Methyl-1-[2-(methylsulfanyl)phenyl]-2-propanol

  • Molecular FormulaC11H16OS
  • Average mass196.309 Da
  • Monoisotopic mass196.092178 Da
  • ChemSpider ID35330926

More details:

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

1379369-64-8 [RN]
2-Methyl-1-[2-(methylsulfanyl)phenyl]-2-propanol [German] [ACD/IUPAC Name]
2-Methyl-1-[2-(methylsulfanyl)phenyl]-2-propanol [ACD/IUPAC Name]
2-Méthyl-1-[2-(méthylsulfanyl)phényl]-2-propanol [French] [ACD/IUPAC Name]
Benzeneethanol, α,α-dimethyl-2-(methylthio)- [ACD/Index Name]
1-[2-(Methylthio)phenyl]-2-methyl-2-propanol
2-methyl-1-[2-(methylsulfanyl)phenyl]propan-2-ol
atoms 13 bonds 13
MFCD20528386

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

Density: 1.1±0.1 g/cm3
Boiling Point: 298.1±23.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.7 mmHg at 25°C
Enthalpy of Vaporization: 56.8±3.0 kJ/mol
Flash Point: 145.3±21.3 °C
Index of Refraction: 1.560
Molar Refractivity: 59.5±0.4 cm3
#H bond acceptors: 1
#H bond donors: 1
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: 2.54
ACD/LogD (pH 5.5): 2.84
ACD/BCF (pH 5.5): 84.43
ACD/KOC (pH 5.5): 832.91
ACD/LogD (pH 7.4): 2.84
ACD/BCF (pH 7.4): 84.43
ACD/KOC (pH 7.4): 832.91
Polar Surface Area: 46 Å2
Polarizability: 23.6±0.5 10-24cm3
Surface Tension: 41.9±5.0 dyne/cm
Molar Volume: 183.9±5.0 cm3

Click to predict properties on the Chemicalize site


Advertisement