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

1-(2-Chloroethyl)-3-isobutylthiourea

  • Molecular FormulaC7H15ClN2S
  • Average mass194.725 Da
  • Monoisotopic mass194.064453 Da
  • ChemSpider ID60463199

More details:

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

1-(2-Chlorethyl)-3-isobutylthioharnstoff [German] [ACD/IUPAC Name]
1-(2-Chloroethyl)-3-isobutylthiourea [ACD/IUPAC Name]
1-(2-Chloroéthyl)-3-isobutylthiourée [French] [ACD/IUPAC Name]
Thiourea, N-(2-chloroethyl)-N'-(2-methylpropyl)- [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: 251.4±42.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.5 mmHg at 25°C
Enthalpy of Vaporization: 48.9±3.0 kJ/mol
Flash Point: 105.9±27.9 °C
Index of Refraction: 1.514
Molar Refractivity: 53.8±0.3 cm3
#H bond acceptors: 2
#H bond donors: 2
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 0
ACD/LogP: 1.66
ACD/LogD (pH 5.5): 1.63
ACD/BCF (pH 5.5): 10.24
ACD/KOC (pH 5.5): 183.98
ACD/LogD (pH 7.4): 1.63
ACD/BCF (pH 7.4): 10.24
ACD/KOC (pH 7.4): 183.98
Polar Surface Area: 56 Å2
Polarizability: 21.3±0.5 10-24cm3
Surface Tension: 40.0±3.0 dyne/cm
Molar Volume: 178.5±3.0 cm3

Click to predict properties on the Chemicalize site


Advertisement