ChemSpider 2D Image | 2-[(3,5-Dimethyl-1H-pyrazol-1-yl)methyl]-1-[3-(methylsulfonyl)propyl]piperidine | C15H27N3O2S

2-[(3,5-Dimethyl-1H-pyrazol-1-yl)methyl]-1-[3-(methylsulfonyl)propyl]piperidine

  • Molecular FormulaC15H27N3O2S
  • Average mass313.459 Da
  • Monoisotopic mass313.182404 Da
  • ChemSpider ID30348800

More details:

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

2-[(3,5-Dimethyl-1H-pyrazol-1-yl)methyl]-1-[3-(methylsulfonyl)propyl]piperidin [German] [ACD/IUPAC Name]
2-[(3,5-Dimethyl-1H-pyrazol-1-yl)methyl]-1-[3-(methylsulfonyl)propyl]piperidine [ACD/IUPAC Name]
2-[(3,5-Diméthyl-1H-pyrazol-1-yl)méthyl]-1-[3-(méthylsulfonyl)propyl]pipéridine [French] [ACD/IUPAC Name]
Piperidine, 2-[(3,5-dimethyl-1H-pyrazol-1-yl)methyl]-1-[3-(methylsulfonyl)propyl]- [ACD/Index Name]

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

Density: 1.2±0.1 g/cm3
Boiling Point: 497.7±35.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.3 mmHg at 25°C
Enthalpy of Vaporization: 76.6±3.0 kJ/mol
Flash Point: 254.8±25.9 °C
Index of Refraction: 1.579
Molar Refractivity: 86.7±0.5 cm3
#H bond acceptors: 5
#H bond donors: 0
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 0
ACD/LogP: 1.35
ACD/LogD (pH 5.5): -1.35
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): 0.25
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 9.61
Polar Surface Area: 64 Å2
Polarizability: 34.4±0.5 10-24cm3
Surface Tension: 43.5±7.0 dyne/cm
Molar Volume: 261.1±7.0 cm3

Click to predict properties on the Chemicalize site


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