ChemSpider 2D Image | 5-{[3-(Ethylsulfanyl)cyclopentyl](methyl)amino}pentanenitrile | C13H24N2S

5-{[3-(Ethylsulfanyl)cyclopentyl](methyl)amino}pentanenitrile

  • Molecular FormulaC13H24N2S
  • Average mass240.408 Da
  • Monoisotopic mass240.166016 Da
  • ChemSpider ID30262195

More details:

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

5-{[3-(Ethylsulfanyl)cyclopentyl](methyl)amino}pentanenitrile [ACD/IUPAC Name]
5-{[3-(Éthylsulfanyl)cyclopentyl](méthyl)amino}pentanenitrile [French] [ACD/IUPAC Name]
5-{[3-(Ethylsulfanyl)cyclopentyl](methyl)amino}pentannitril [German] [ACD/IUPAC Name]
Pentanenitrile, 5-[[3-(ethylthio)cyclopentyl]methylamino]- [ACD/Index Name]

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

Density: 1.0±0.1 g/cm3
Boiling Point: 386.6±37.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.9 mmHg at 25°C
Enthalpy of Vaporization: 63.6±3.0 kJ/mol
Flash Point: 187.6±26.5 °C
Index of Refraction: 1.512
Molar Refractivity: 72.0±0.4 cm3
#H bond acceptors: 2
#H bond donors: 0
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 0
ACD/LogP: 1.06
ACD/LogD (pH 5.5): -0.64
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): 0.55
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 6.97
Polar Surface Area: 52 Å2
Polarizability: 28.5±0.5 10-24cm3
Surface Tension: 40.4±5.0 dyne/cm
Molar Volume: 240.1±5.0 cm3

Click to predict properties on the Chemicalize site


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