ChemSpider 2D Image | 1-(3-Ethyl-1,4-dithian-2-yl)-2-methyl-N-propyl-1-pentanamine (non-preferred name) | C15H31NS2

1-(3-Ethyl-1,4-dithian-2-yl)-2-methyl-N-propyl-1-pentanamine (non-preferred name)

  • Molecular FormulaC15H31NS2
  • Average mass289.543 Da
  • Monoisotopic mass289.189789 Da
  • ChemSpider ID47604440

More details:

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

1-(3-Ethyl-1,4-dithian-2-yl)-2-methyl-N-propyl-1-pentanamin (non-preferred name) [German] [ACD/IUPAC Name]
1-(3-Ethyl-1,4-dithian-2-yl)-2-methyl-N-propyl-1-pentanamine (non-preferred name) [ACD/IUPAC Name]
1-(3-Éthyl-1,4-dithian-2-yl)-2-méthyl-N-propyl-1-pentanamine (non-preferred name) [French] [ACD/IUPAC 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: 382.7±17.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.9 mmHg at 25°C
Enthalpy of Vaporization: 63.1±3.0 kJ/mol
Flash Point: 185.3±20.9 °C
Index of Refraction: 1.501
Molar Refractivity: 89.3±0.3 cm3
#H bond acceptors: 1
#H bond donors: 1
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 0
ACD/LogP: 4.94
ACD/LogD (pH 5.5): 1.46
ACD/BCF (pH 5.5): 1.43
ACD/KOC (pH 5.5): 6.21
ACD/LogD (pH 7.4): 2.60
ACD/BCF (pH 7.4): 19.44
ACD/KOC (pH 7.4): 84.63
Polar Surface Area: 63 Å2
Polarizability: 35.4±0.5 10-24cm3
Surface Tension: 32.9±3.0 dyne/cm
Molar Volume: 303.3±3.0 cm3

Click to predict properties on the Chemicalize site


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