ChemSpider 2D Image | Vortioxetine-d8 | C18H14D8N2S

Vortioxetine-d8

  • Molecular FormulaC18H14D8N2S
  • Average mass306.495 Da
  • Monoisotopic mass306.200592 Da
  • ChemSpider ID76714542

  • Non-standard isotope - Non-standard isotope

More details:

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

1-{2-[(2,4-Dimethylphenyl)sulfanyl]phenyl}(2,2,3,3,5,5,6,6-2H8)piperazin [German] [ACD/IUPAC Name]
1-{2-[(2,4-Dimethylphenyl)sulfanyl]phenyl}(2,2,3,3,5,5,6,6-2H8)piperazine [ACD/IUPAC Name]
1-{2-[(2,4-Diméthylphényl)sulfanyl]phényl}(2,2,3,3,5,5,6,6-2H8)pipérazine [French] [ACD/IUPAC Name]
2140316-62-5 [RN]
Piperazine-2,2,3,3,5,5,6,6-d8, 1-[2-[(2,4-dimethylphenyl)thio]phenyl]- [ACD/Index Name]
Piperazine-2,2,3,3,5,5,6,6-d8, 1-[2-[[2-methyl-4-(methyl-d3)phenyl]thio]phenyl]-
Vortioxetine-d8
1-(2-((2,4-dimethylphenyl)thio)phenyl)piperazine-2,2,3,3,5,5,6,6-d8
2,2,3,3,5,5,6,6-octadeuterio-1-[2-(2,4-dimethylphenyl)sulfanylphenyl]piperazine
vortioxetine d8

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

Density: 1.2±0.1 g/cm3
Boiling Point: 424.8±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.0 mmHg at 25°C
Enthalpy of Vaporization: 67.9±3.0 kJ/mol
Flash Point: 210.7±28.7 °C
Index of Refraction: 1.643
Molar Refractivity: 92.7±0.4 cm3
#H bond acceptors: 2
#H bond donors: 1
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: 4.26
ACD/LogD (pH 5.5): 1.78
ACD/BCF (pH 5.5): 2.85
ACD/KOC (pH 5.5): 11.95
ACD/LogD (pH 7.4): 3.37
ACD/BCF (pH 7.4): 112.25
ACD/KOC (pH 7.4): 471.58
Polar Surface Area: 41 Å2
Polarizability: 36.8±0.5 10-24cm3
Surface Tension: 52.4±5.0 dyne/cm
Molar Volume: 256.5±5.0 cm3

Click to predict properties on the Chemicalize site


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