ChemSpider 2D Image | 1-[2-Hydroxy-2-(2-thienyl)propyl]-3-[1-(methylsulfanyl)-2-propanyl]urea | C12H20N2O2S2

1-[2-Hydroxy-2-(2-thienyl)propyl]-3-[1-(methylsulfanyl)-2-propanyl]urea

  • Molecular FormulaC12H20N2O2S2
  • Average mass288.429 Da
  • Monoisotopic mass288.096619 Da
  • ChemSpider ID34439156

More details:

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

1-[2-Hydroxy-2-(2-thienyl)propyl]-3-[1-(methylsulfanyl)-2-propanyl]harnstoff [German] [ACD/IUPAC Name]
1-[2-Hydroxy-2-(2-thienyl)propyl]-3-[1-(methylsulfanyl)-2-propanyl]urea [ACD/IUPAC Name]
1-[2-Hydroxy-2-(2-thiényl)propyl]-3-[1-(méthylsulfanyl)-2-propanyl]urée [French] [ACD/IUPAC Name]
Urea, N-[2-hydroxy-2-(2-thienyl)propyl]-N'-[1-methyl-2-(methylthio)ethyl]- [ACD/Index Name]
1-[2-HYDROXY-2-(THIOPHEN-2-YL)PROPYL]-3-[1-(METHYLSULFANYL)PROPAN-2-YL]UREA

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

Density: 1.2±0.1 g/cm3
Boiling Point: 528.5±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.5 mmHg at 25°C
Enthalpy of Vaporization: 84.6±3.0 kJ/mol
Flash Point: 273.4±30.1 °C
Index of Refraction: 1.571
Molar Refractivity: 78.3±0.3 cm3
#H bond acceptors: 4
#H bond donors: 3
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 0
ACD/LogP: 1.43
ACD/LogD (pH 5.5): 1.80
ACD/BCF (pH 5.5): 13.73
ACD/KOC (pH 5.5): 227.03
ACD/LogD (pH 7.4): 1.80
ACD/BCF (pH 7.4): 13.73
ACD/KOC (pH 7.4): 227.03
Polar Surface Area: 115 Å2
Polarizability: 31.0±0.5 10-24cm3
Surface Tension: 46.9±3.0 dyne/cm
Molar Volume: 238.2±3.0 cm3

Click to predict properties on the Chemicalize site


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