ChemSpider 2D Image | 2-(3-Methylphenyl)-1-[3-(methylsulfanyl)propyl]pyrrolidine | C15H23NS

2-(3-Methylphenyl)-1-[3-(methylsulfanyl)propyl]pyrrolidine

  • Molecular FormulaC15H23NS
  • Average mass249.415 Da
  • Monoisotopic mass249.155121 Da
  • ChemSpider ID29822250

More details:

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

2-(3-Methylphenyl)-1-[3-(methylsulfanyl)propyl]pyrrolidin [German] [ACD/IUPAC Name]
2-(3-Methylphenyl)-1-[3-(methylsulfanyl)propyl]pyrrolidine [ACD/IUPAC Name]
2-(3-Méthylphényl)-1-[3-(méthylsulfanyl)propyl]pyrrolidine [French] [ACD/IUPAC Name]
Pyrrolidine, 2-(3-methylphenyl)-1-[3-(methylthio)propyl]- [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: 363.2±37.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.8 mmHg at 25°C
Enthalpy of Vaporization: 60.9±3.0 kJ/mol
Flash Point: 173.5±26.5 °C
Index of Refraction: 1.549
Molar Refractivity: 77.9±0.3 cm3
#H bond acceptors: 1
#H bond donors: 0
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 0
ACD/LogP: 3.80
ACD/LogD (pH 5.5): 1.39
ACD/BCF (pH 5.5): 1.23
ACD/KOC (pH 5.5): 5.41
ACD/LogD (pH 7.4): 2.20
ACD/BCF (pH 7.4): 7.96
ACD/KOC (pH 7.4): 35.10
Polar Surface Area: 29 Å2
Polarizability: 30.9±0.5 10-24cm3
Surface Tension: 38.5±3.0 dyne/cm
Molar Volume: 244.8±3.0 cm3

Click to predict properties on the Chemicalize site


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