ChemSpider 2D Image | 2-(2-Methyl-2-propanyl)-4H-chromene-4-thione | C13H14OS

2-(2-Methyl-2-propanyl)-4H-chromene-4-thione

  • Molecular FormulaC13H14OS
  • Average mass218.315 Da
  • Monoisotopic mass218.076538 Da
  • ChemSpider ID21623091

More details:

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

2-(2-Methyl-2-propanyl)-4H-chromen-4-thion [German] [ACD/IUPAC Name]
2-(2-Methyl-2-propanyl)-4H-chromene-4-thione [ACD/IUPAC Name]
2-(2-Méthyl-2-propanyl)-4H-chromène-4-thione [French] [ACD/IUPAC Name]
4H-1-Benzopyran-4-thione, 2-(1,1-dimethylethyl)- [ACD/Index Name]
2-t-butyl-4-thiochromone
2-tert-butyl-4H-chromene-4-thione
2-TERT-BUTYLCHROMENE-4-THIONE

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

Density: 1.1±0.1 g/cm3
Boiling Point: 290.8±43.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.6 mmHg at 25°C
Enthalpy of Vaporization: 50.9±3.0 kJ/mol
Flash Point: 129.7±28.2 °C
Index of Refraction: 1.604
Molar Refractivity: 65.7±0.4 cm3
#H bond acceptors: 1
#H bond donors: 0
#Freely Rotating Bonds: 1
#Rule of 5 Violations: 0
ACD/LogP: 3.58
ACD/LogD (pH 5.5): 4.16
ACD/BCF (pH 5.5): 850.09
ACD/KOC (pH 5.5): 4350.23
ACD/LogD (pH 7.4): 4.16
ACD/BCF (pH 7.4): 850.09
ACD/KOC (pH 7.4): 4350.23
Polar Surface Area: 41 Å2
Polarizability: 26.0±0.5 10-24cm3
Surface Tension: 47.0±5.0 dyne/cm
Molar Volume: 191.0±5.0 cm3

Click to predict properties on the Chemicalize site


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