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Search term: LMKLYHDAVGDYQB (Found by InChIKey (skeleton match))
ChemSpider 2D Image | 1-{[1-(2,5-Dichloro-3-thienyl)ethyl]amino}-2-pentanol | C11H17Cl2NOS

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

  • Molecular FormulaC11H17Cl2NOS
  • Average mass282.230 Da
  • Monoisotopic mass281.040802 Da
  • ChemSpider ID41856913

More details:

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

1-{[1-(2,5-Dichlor-3-thienyl)ethyl]amino}-2-pentanol [German] [ACD/IUPAC Name]
1-{[1-(2,5-Dichloro-3-thienyl)ethyl]amino}-2-pentanol [ACD/IUPAC Name]
1-{[1-(2,5-Dichloro-3-thiényl)éthyl]amino}-2-pentanol [French] [ACD/IUPAC Name]
2-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, version: 14.00

Density: 1.3±0.1 g/cm3
Boiling Point: 374.0±37.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.9 mmHg at 25°C
Enthalpy of Vaporization: 65.5±3.0 kJ/mol
Flash Point: 180.0±26.5 °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: 3.86
ACD/LogD (pH 5.5): 2.20
ACD/BCF (pH 5.5): 12.78
ACD/KOC (pH 5.5): 86.02
ACD/LogD (pH 7.4): 3.49
ACD/BCF (pH 7.4): 246.94
ACD/KOC (pH 7.4): 1662.02
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

Click to predict properties on the Chemicalize site


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