ChemSpider 2D Image | 4-(1,3-Thiazol-2-ylsulfanyl)-1-butanol | C7H11NOS2

4-(1,3-Thiazol-2-ylsulfanyl)-1-butanol

  • Molecular FormulaC7H11NOS2
  • Average mass189.298 Da
  • Monoisotopic mass189.028198 Da
  • ChemSpider ID69012429

More details:

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

1-Butanol, 4-(2-thiazolylthio)- [ACD/Index Name]
4-(1,3-Thiazol-2-ylsulfanyl)-1-butanol [German] [ACD/IUPAC Name]
4-(1,3-Thiazol-2-ylsulfanyl)-1-butanol [ACD/IUPAC Name]
4-(1,3-Thiazol-2-ylsulfanyl)-1-butanol [French] [ACD/IUPAC Name]

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

Density: 1.3±0.1 g/cm3
Boiling Point: 326.0±44.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.7 mmHg at 25°C
Enthalpy of Vaporization: 60.0±3.0 kJ/mol
Flash Point: 151.0±28.4 °C
Index of Refraction: 1.590
Molar Refractivity: 50.8±0.4 cm3
#H bond acceptors: 2
#H bond donors: 1
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 0
ACD/LogP: 1.68
ACD/LogD (pH 5.5): 1.48
ACD/BCF (pH 5.5): 7.82
ACD/KOC (pH 5.5): 151.75
ACD/LogD (pH 7.4): 1.48
ACD/BCF (pH 7.4): 7.83
ACD/KOC (pH 7.4): 151.79
Polar Surface Area: 87 Å2
Polarizability: 20.1±0.5 10-24cm3
Surface Tension: 57.3±5.0 dyne/cm
Molar Volume: 150.3±5.0 cm3

Click to predict properties on the Chemicalize site


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