ChemSpider 2D Image | 1-Butyl-3-(2-chloroethyl)thiourea | C7H15ClN2S

1-Butyl-3-(2-chloroethyl)thiourea

  • Molecular FormulaC7H15ClN2S
  • Average mass194.725 Da
  • Monoisotopic mass194.064453 Da
  • ChemSpider ID60463399

More details:

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

1-Butyl-3-(2-chlorethyl)thioharnstoff [German] [ACD/IUPAC Name]
1-Butyl-3-(2-chloroethyl)thiourea [ACD/IUPAC Name]
1-Butyl-3-(2-chloroéthyl)thiourée [French] [ACD/IUPAC Name]
Thiourea, N-butyl-N'-(2-chloroethyl)- [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: 257.6±42.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.5 mmHg at 25°C
Enthalpy of Vaporization: 49.5±3.0 kJ/mol
Flash Point: 109.6±27.9 °C
Index of Refraction: 1.516
Molar Refractivity: 53.8±0.3 cm3
#H bond acceptors: 2
#H bond donors: 2
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 0
ACD/LogP: 1.85
ACD/LogD (pH 5.5): 1.74
ACD/BCF (pH 5.5): 12.45
ACD/KOC (pH 5.5): 211.58
ACD/LogD (pH 7.4): 1.74
ACD/BCF (pH 7.4): 12.45
ACD/KOC (pH 7.4): 211.58
Polar Surface Area: 56 Å2
Polarizability: 21.3±0.5 10-24cm3
Surface Tension: 41.3±3.0 dyne/cm
Molar Volume: 178.1±3.0 cm3

Click to predict properties on the Chemicalize site


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