ChemSpider 2D Image | 2-{[4-(4-Chlorophenoxy)butyl]sulfinyl}-N,N-diethylethanamine | C16H26ClNO2S

2-{[4-(4-Chlorophenoxy)butyl]sulfinyl}-N,N-diethylethanamine

  • Molecular FormulaC16H26ClNO2S
  • Average mass331.901 Da
  • Monoisotopic mass331.137268 Da
  • ChemSpider ID60198066

More details:

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

2-{[4-(4-Chlorophenoxy)butyl]sulfinyl}-N,N-diethylethanamine [ACD/IUPAC Name]
2-{[4-(4-Chlorophénoxy)butyl]sulfinyl}-N,N-diéthyléthanamine [French] [ACD/IUPAC Name]
2-{[4-(4-Chlorphenoxy)butyl]sulfinyl}-N,N-diethylethanamin [German] [ACD/IUPAC Name]
Ethanamine, 2-[[4-(4-chlorophenoxy)butyl]sulfinyl]-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: 488.7±35.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.2 mmHg at 25°C
Enthalpy of Vaporization: 75.5±3.0 kJ/mol
Flash Point: 249.4±25.9 °C
Index of Refraction: 1.546
Molar Refractivity: 92.1±0.3 cm3
#H bond acceptors: 3
#H bond donors: 0
#Freely Rotating Bonds: 11
#Rule of 5 Violations: 0
ACD/LogP: 3.28
ACD/LogD (pH 5.5): 0.30
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.43
ACD/LogD (pH 7.4): 1.40
ACD/BCF (pH 7.4): 2.36
ACD/KOC (pH 7.4): 18.27
Polar Surface Area: 49 Å2
Polarizability: 36.5±0.5 10-24cm3
Surface Tension: 45.4±3.0 dyne/cm
Molar Volume: 290.7±3.0 cm3

Click to predict properties on the Chemicalize site


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