ChemSpider 2D Image | 1-{[1-(2,5-Dichloro-3-thienyl)ethyl]amino}-3-pentanol | C11H17Cl2NOS

1-{[1-(2,5-Dichloro-3-thienyl)ethyl]amino}-3-pentanol

  • Molecular FormulaC11H17Cl2NOS
  • Average mass282.230 Da
  • Monoisotopic mass281.040802 Da
  • ChemSpider ID41632652

More details:






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

1-{[1-(2,5-Dichlor-3-thienyl)ethyl]amino}-3-pentanol [German] [ACD/IUPAC Name]
1-{[1-(2,5-Dichloro-3-thienyl)ethyl]amino}-3-pentanol [ACD/IUPAC Name]
1-{[1-(2,5-Dichloro-3-thiényl)éthyl]amino}-3-pentanol [French] [ACD/IUPAC Name]
3-Pentanol, 1-[[1-(2,5-dichloro-3-thienyl)ethyl]amino]- [ACD/Index Name]

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module

Density: 1.3±0.1 g/cm3
Boiling Point: 366.2±42.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.9 mmHg at 25°C
Enthalpy of Vaporization: 64.6±3.0 kJ/mol
Flash Point: 175.3±27.9 °C
Index of Refraction: 1.553
Molar Refractivity: 72.2±0.3 cm3
#H bond acceptors: 2
#H bond donors: 2
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 0
ACD/LogP: 3.31
ACD/LogD (pH 5.5): 0.98
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 7.48
ACD/LogD (pH 7.4): 2.68
ACD/BCF (pH 7.4): 46.63
ACD/KOC (pH 7.4): 374.08
Polar Surface Area: 61 Å2
Polarizability: 28.6±0.5 10-24cm3
Surface Tension: 43.2±3.0 dyne/cm
Molar Volume: 225.6±3.0 cm3

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