ChemSpider 2D Image | 1-(4-{[2-(Dimethylamino)ethyl]sulfanyl}phenyl)-2-propanamine | C13H22N2S

1-(4-{[2-(Dimethylamino)ethyl]sulfanyl}phenyl)-2-propanamine

  • Molecular FormulaC13H22N2S
  • Average mass238.392 Da
  • Monoisotopic mass238.150375 Da
  • ChemSpider ID24658135

More details:

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

1-(4-{[2-(Dimethylamino)ethyl]sulfanyl}phenyl)-2-propanamin [German] [ACD/IUPAC Name]
1-(4-{[2-(Dimethylamino)ethyl]sulfanyl}phenyl)-2-propanamine [ACD/IUPAC Name]
1-(4-{[2-(Diméthylamino)éthyl]sulfanyl}phényl)-2-propanamine [French] [ACD/IUPAC Name]
Benzeneethanamine, 4-[[2-(dimethylamino)ethyl]thio]-α-methyl- [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: 345.7±32.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.8 mmHg at 25°C
Enthalpy of Vaporization: 59.0±3.0 kJ/mol
Flash Point: 162.9±25.1 °C
Index of Refraction: 1.564
Molar Refractivity: 74.7±0.4 cm3
#H bond acceptors: 2
#H bond donors: 2
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 0
ACD/LogP: 2.14
ACD/LogD (pH 5.5): -1.67
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -1.17
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 55 Å2
Polarizability: 29.6±0.5 10-24cm3
Surface Tension: 43.2±5.0 dyne/cm
Molar Volume: 229.6±5.0 cm3

Click to predict properties on the Chemicalize site


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