ChemSpider 2D Image | 3-(1-{[2,3-Dimethyl-5-(2-methyl-2-propanyl)phenyl]sulfonyl}-2-piperidinyl)-1-propanol | C20H33NO3S

3-(1-{[2,3-Dimethyl-5-(2-methyl-2-propanyl)phenyl]sulfonyl}-2-piperidinyl)-1-propanol

  • Molecular FormulaC20H33NO3S
  • Average mass367.546 Da
  • Monoisotopic mass367.218109 Da
  • ChemSpider ID67898012

More details:

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

2-Piperidinepropanol, 1-[[5-(1,1-dimethylethyl)-2,3-dimethylphenyl]sulfonyl]- [ACD/Index Name]
3-(1-{[2,3-Dimethyl-5-(2-methyl-2-propanyl)phenyl]sulfonyl}-2-piperidinyl)-1-propanol [German] [ACD/IUPAC Name]
3-(1-{[2,3-Dimethyl-5-(2-methyl-2-propanyl)phenyl]sulfonyl}-2-piperidinyl)-1-propanol [ACD/IUPAC Name]
3-(1-{[2,3-Diméthyl-5-(2-méthyl-2-propanyl)phényl]sulfonyl}-2-pipéridinyl)-1-propanol [French] [ACD/IUPAC 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: 507.8±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.4 mmHg at 25°C
Enthalpy of Vaporization: 81.9±3.0 kJ/mol
Flash Point: 260.9±32.9 °C
Index of Refraction: 1.530
Molar Refractivity: 103.7±0.4 cm3
#H bond acceptors: 4
#H bond donors: 1
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 0
ACD/LogP: 4.73
ACD/LogD (pH 5.5): 4.87
ACD/BCF (pH 5.5): 2937.22
ACD/KOC (pH 5.5): 10566.82
ACD/LogD (pH 7.4): 4.87
ACD/BCF (pH 7.4): 2937.22
ACD/KOC (pH 7.4): 10566.82
Polar Surface Area: 66 Å2
Polarizability: 41.1±0.5 10-24cm3
Surface Tension: 40.6±3.0 dyne/cm
Molar Volume: 335.6±3.0 cm3

Click to predict properties on the Chemicalize site


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