ChemSpider 2D Image | 4-[(1E)-3,4,4-Trichloro-2-nitro-1-(propylsulfanyl)-1,3-butadien-1-yl]thiomorpholine | C11H15Cl3N2O2S2

4-[(1E)-3,4,4-Trichloro-2-nitro-1-(propylsulfanyl)-1,3-butadien-1-yl]thiomorpholine

  • Molecular FormulaC11H15Cl3N2O2S2
  • Average mass377.738 Da
  • Monoisotopic mass375.964050 Da
  • ChemSpider ID21178321

  • Double-bond stereo - Double-bond stereo

More details:

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

4-[(1E)-3,4,4-Trichlor-2-nitro-1-(propylsulfanyl)-1,3-butadien-1-yl]thiomorpholin [German] [ACD/IUPAC Name]
4-[(1E)-3,4,4-Trichloro-2-nitro-1-(propylsulfanyl)-1,3-butadien-1-yl]thiomorpholine [ACD/IUPAC Name]
4-[(1E)-3,4,4-Trichloro-2-nitro-1-(propylsulfanyl)-1,3-butadién-1-yl]thiomorpholine [French] [ACD/IUPAC Name]
Thiomorpholine, 4-[(1E)-3,4,4-trichloro-2-nitro-1-(propylthio)-1,3-butadien-1-yl]- [ACD/Index Name]

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

Density: 1.4±0.1 g/cm3
Boiling Point: 330.8±42.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.7 mmHg at 25°C
Enthalpy of Vaporization: 57.3±3.0 kJ/mol
Flash Point: 153.9±27.9 °C
Index of Refraction: 1.611
Molar Refractivity: 90.6±0.3 cm3
#H bond acceptors: 4
#H bond donors: 0
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 0
ACD/LogP: 3.94
ACD/LogD (pH 5.5): 4.26
ACD/BCF (pH 5.5): 1024.53
ACD/KOC (pH 5.5): 4972.04
ACD/LogD (pH 7.4): 4.26
ACD/BCF (pH 7.4): 1024.53
ACD/KOC (pH 7.4): 4972.04
Polar Surface Area: 100 Å2
Polarizability: 35.9±0.5 10-24cm3
Surface Tension: 54.2±3.0 dyne/cm
Molar Volume: 261.0±3.0 cm3

Click to predict properties on the Chemicalize site


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