ChemSpider 2D Image | N-[2-(Phenylsulfanyl)ethyl]tetrahydro-3-thiophenamine | C12H17NS2

N-[2-(Phenylsulfanyl)ethyl]tetrahydro-3-thiophenamine

  • Molecular FormulaC12H17NS2
  • Average mass239.400 Da
  • Monoisotopic mass239.080246 Da
  • ChemSpider ID37892438

More details:

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

3-Thiophenamine, tetrahydro-N-[2-(phenylthio)ethyl]- [ACD/Index Name]
N-[2-(Phenylsulfanyl)ethyl]tetrahydro-3-thiophenamin [German] [ACD/IUPAC Name]
N-[2-(Phenylsulfanyl)ethyl]tetrahydro-3-thiophenamine [ACD/IUPAC Name]
N-[2-(Phénylsulfanyl)éthyl]tétrahydro-3-thiophénamine [French] [ACD/IUPAC Name]
1183122-94-2 [RN]
MFCD12811431

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

Density: 1.2±0.1 g/cm3
Boiling Point: 388.8±37.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.9 mmHg at 25°C
Enthalpy of Vaporization: 63.8±3.0 kJ/mol
Flash Point: 189.0±26.5 °C
Index of Refraction: 1.616
Molar Refractivity: 72.2±0.4 cm3
#H bond acceptors: 1
#H bond donors: 1
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 0
ACD/LogP: 2.73
ACD/LogD (pH 5.5): 0.14
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.39
ACD/LogD (pH 7.4): 1.64
ACD/BCF (pH 7.4): 4.83
ACD/KOC (pH 7.4): 43.50
Polar Surface Area: 63 Å2
Polarizability: 28.6±0.5 10-24cm3
Surface Tension: 48.9±5.0 dyne/cm
Molar Volume: 206.4±5.0 cm3

Click to predict properties on the Chemicalize site


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