ChemSpider 2D Image | 3-(2-Chloroethyl)-1,1-diethylthiourea | C7H15ClN2S

3-(2-Chloroethyl)-1,1-diethylthiourea

  • Molecular FormulaC7H15ClN2S
  • Average mass194.725 Da
  • Monoisotopic mass194.064453 Da
  • ChemSpider ID60321529

More details:

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

3-(2-Chlorethyl)-1,1-diethylthioharnstoff [German] [ACD/IUPAC Name]
3-(2-Chloroethyl)-1,1-diethylthiourea [ACD/IUPAC Name]
3-(2-Chloroéthyl)-1,1-diéthylthiourée [French] [ACD/IUPAC Name]
Thiourea, N'-(2-chloroethyl)-N,N-diethyl- [ACD/Index Name]

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

Density: 1.1±0.1 g/cm3
Boiling Point: 246.3±42.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.5 mmHg at 25°C
Enthalpy of Vaporization: 48.3±3.0 kJ/mol
Flash Point: 102.7±27.9 °C
Index of Refraction: 1.523
Molar Refractivity: 53.9±0.3 cm3
#H bond acceptors: 2
#H bond donors: 1
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 0
ACD/LogP: 1.32
ACD/LogD (pH 5.5): 1.50
ACD/BCF (pH 5.5): 8.08
ACD/KOC (pH 5.5): 155.29
ACD/LogD (pH 7.4): 1.50
ACD/BCF (pH 7.4): 8.08
ACD/KOC (pH 7.4): 155.29
Polar Surface Area: 47 Å2
Polarizability: 21.4±0.5 10-24cm3
Surface Tension: 42.0±3.0 dyne/cm
Molar Volume: 176.5±3.0 cm3

Click to predict properties on the Chemicalize site


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