ChemSpider 2D Image | 1-Butyl-3-(1,1-dioxido-3-thietanyl)thiourea | C8H16N2O2S2

1-Butyl-3-(1,1-dioxido-3-thietanyl)thiourea

  • Molecular FormulaC8H16N2O2S2
  • Average mass236.355 Da
  • Monoisotopic mass236.065323 Da
  • ChemSpider ID71045078

More details:

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

1-Butyl-3-(1,1-dioxido-3-thietanyl)thioharnstoff [German] [ACD/IUPAC Name]
1-Butyl-3-(1,1-dioxido-3-thietanyl)thiourea [ACD/IUPAC Name]
1-Butyl-3-(1,1-dioxydo-3-thiétanyl)thiourée [French] [ACD/IUPAC Name]
Thiourea, N-butyl-N'-(1,1-dioxido-3-thietanyl)- [ACD/Index Name]
1852208-07-1 [RN]
1-Butyl-3-(1,1-dioxidothietan-3-yl)thiourea

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

Density: 1.3±0.1 g/cm3
Boiling Point: 412.1±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.0 mmHg at 25°C
Enthalpy of Vaporization: 66.5±3.0 kJ/mol
Flash Point: 203.0±31.5 °C
Index of Refraction: 1.570
Molar Refractivity: 60.3±0.4 cm3
#H bond acceptors: 4
#H bond donors: 2
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 0
ACD/LogP: -0.20
ACD/LogD (pH 5.5): -0.12
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 20.62
ACD/LogD (pH 7.4): -0.12
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 20.62
Polar Surface Area: 99 Å2
Polarizability: 23.9±0.5 10-24cm3
Surface Tension: 55.7±5.0 dyne/cm
Molar Volume: 183.6±5.0 cm3

Click to predict properties on the Chemicalize site


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