ChemSpider 2D Image | 1-(5,6-Dimethyl-1,4-dithian-2-yl)-4-methyl-N-propyl-1-pentanamine | C15H31NS2

1-(5,6-Dimethyl-1,4-dithian-2-yl)-4-methyl-N-propyl-1-pentanamine

  • Molecular FormulaC15H31NS2
  • Average mass289.543 Da
  • Monoisotopic mass289.189789 Da
  • ChemSpider ID47876127

More details:

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

1-(5,6-Dimethyl-1,4-dithian-2-yl)-4-methyl-N-propyl-1-pentanamin [German] [ACD/IUPAC Name]
1-(5,6-Dimethyl-1,4-dithian-2-yl)-4-methyl-N-propyl-1-pentanamine [ACD/IUPAC Name]
1-(5,6-Diméthyl-1,4-dithian-2-yl)-4-méthyl-N-propyl-1-pentanamine [French] [ACD/IUPAC Name]
1,4-Dithiane-2-methanamine, 5,6-dimethyl-α-(3-methylbutyl)-N-propyl- [ACD/Index Name]

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

Density: 0.9±0.1 g/cm3
Boiling Point: 376.8±17.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.9 mmHg at 25°C
Enthalpy of Vaporization: 62.5±3.0 kJ/mol
Flash Point: 181.7±20.9 °C
Index of Refraction: 1.497
Molar Refractivity: 89.4±0.3 cm3
#H bond acceptors: 1
#H bond donors: 1
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 0
ACD/LogP: 4.90
ACD/LogD (pH 5.5): 2.16
ACD/BCF (pH 5.5): 4.80
ACD/KOC (pH 5.5): 14.50
ACD/LogD (pH 7.4): 3.11
ACD/BCF (pH 7.4): 42.79
ACD/KOC (pH 7.4): 129.29
Polar Surface Area: 63 Å2
Polarizability: 35.4±0.5 10-24cm3
Surface Tension: 31.5±3.0 dyne/cm
Molar Volume: 305.7±3.0 cm3

Click to predict properties on the Chemicalize site


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