ChemSpider 2D Image | 3-[2,5-Dimethoxy-4-(methylsulfanyl)phenyl]piperidine | C14H21NO2S

3-[2,5-Dimethoxy-4-(methylsulfanyl)phenyl]piperidine

  • Molecular FormulaC14H21NO2S
  • Average mass267.387 Da
  • Monoisotopic mass267.129303 Da
  • ChemSpider ID76430524

More details:

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

3-[2,5-Dimethoxy-4-(methylsulfanyl)phenyl]piperidin [German] [ACD/IUPAC Name]
3-[2,5-Dimethoxy-4-(methylsulfanyl)phenyl]piperidine [ACD/IUPAC Name]
3-[2,5-Diméthoxy-4-(méthylsulfanyl)phényl]pipéridine [French] [ACD/IUPAC Name]
Piperidine, 3-[2,5-dimethoxy-4-(methylthio)phenyl]- [ACD/Index Name]

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

Density: 1.1±0.1 g/cm3
Boiling Point: 388.4±42.0 °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: 188.7±27.9 °C
Index of Refraction: 1.565
Molar Refractivity: 76.9±0.4 cm3
#H bond acceptors: 3
#H bond donors: 1
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: 2.95
ACD/LogD (pH 5.5): -0.04
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): 0.74
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 5.35
Polar Surface Area: 56 Å2
Polarizability: 30.5±0.5 10-24cm3
Surface Tension: 44.2±5.0 dyne/cm
Molar Volume: 236.1±5.0 cm3

Click to predict properties on the Chemicalize site


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