ChemSpider 2D Image | 2-{[(4-Isopropylbenzyl)sulfonyl]methyl}-4-methyl-1,3-thiazole | C15H19NO2S2

2-{[(4-Isopropylbenzyl)sulfonyl]methyl}-4-methyl-1,3-thiazole

  • Molecular FormulaC15H19NO2S2
  • Average mass309.447 Da
  • Monoisotopic mass309.085724 Da
  • ChemSpider ID30440099

More details:

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

2-{[(4-Isopropylbenzyl)sulfonyl]methyl}-4-methyl-1,3-thiazol [German] [ACD/IUPAC Name]
2-{[(4-Isopropylbenzyl)sulfonyl]methyl}-4-methyl-1,3-thiazole [ACD/IUPAC Name]
2-{[(4-Isopropylbenzyl)sulfonyl]méthyl}-4-méthyl-1,3-thiazole [French] [ACD/IUPAC Name]
Thiazole, 4-methyl-2-[[[[4-(1-methylethyl)phenyl]methyl]sulfonyl]methyl]- [ACD/Index Name]

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

Density: 1.2±0.1 g/cm3
Boiling Point: 493.3±40.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.2 mmHg at 25°C
Enthalpy of Vaporization: 73.2±3.0 kJ/mol
Flash Point: 252.2±27.3 °C
Index of Refraction: 1.578
Molar Refractivity: 84.0±0.4 cm3
#H bond acceptors: 3
#H bond donors: 0
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 0
ACD/LogP: 4.01
ACD/LogD (pH 5.5): 3.62
ACD/BCF (pH 5.5): 333.74
ACD/KOC (pH 5.5): 2227.52
ACD/LogD (pH 7.4): 3.62
ACD/BCF (pH 7.4): 333.86
ACD/KOC (pH 7.4): 2228.29
Polar Surface Area: 84 Å2
Polarizability: 33.3±0.5 10-24cm3
Surface Tension: 48.9±3.0 dyne/cm
Molar Volume: 253.0±3.0 cm3

Click to predict properties on the Chemicalize site


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