ChemSpider 2D Image | N-(2C-T) Fentanyl | C25H34N2O3S

N-(2C-T) Fentanyl

  • Molecular FormulaC25H34N2O3S
  • Average mass442.614 Da
  • Monoisotopic mass442.229004 Da
  • ChemSpider ID79413327

More details:

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

N-(1-{2-[2,5-Dimethoxy-4-(methylsulfanyl)phenyl]ethyl}-4-piperidinyl)-N-phenylpropanamid [German] [ACD/IUPAC Name]
N-(1-{2-[2,5-Dimethoxy-4-(methylsulfanyl)phenyl]ethyl}-4-piperidinyl)-N-phenylpropanamide [ACD/IUPAC Name]
N-(1-{2-[2,5-Diméthoxy-4-(méthylsulfanyl)phényl]éthyl}-4-pipéridinyl)-N-phénylpropanamide [French] [ACD/IUPAC Name]
N-(2C-T) Fentanyl
Propanamide, N-[1-[2-[2,5-dimethoxy-4-(methylthio)phenyl]ethyl]-4-piperidinyl]-N-phenyl- [ACD/Index Name]
N-(1-(2,5-dimethoxy-4-(methylthio)phenethyl)piperidin-4-yl)-N-phenylpropionamide

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

Density: 1.2±0.1 g/cm3
Boiling Point: 567.5±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.6 mmHg at 25°C
Enthalpy of Vaporization: 85.2±3.0 kJ/mol
Flash Point: 297.0±30.1 °C
Index of Refraction: 1.598
Molar Refractivity: 129.0±0.4 cm3
#H bond acceptors: 5
#H bond donors: 0
#Freely Rotating Bonds: 9
#Rule of 5 Violations: 0
ACD/LogP: 4.29
ACD/LogD (pH 5.5): 2.34
ACD/BCF (pH 5.5): 9.59
ACD/KOC (pH 5.5): 37.81
ACD/LogD (pH 7.4): 4.04
ACD/BCF (pH 7.4): 487.67
ACD/KOC (pH 7.4): 1922.37
Polar Surface Area: 67 Å2
Polarizability: 51.1±0.5 10-24cm3
Surface Tension: 51.4±5.0 dyne/cm
Molar Volume: 378.1±5.0 cm3

Click to predict properties on the Chemicalize site


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