ChemSpider 2D Image | [3-(3-Methyl-2-buten-1-yl)-1-(methylsulfonyl)-3-piperidinyl]methanol | C12H23NO3S

[3-(3-Methyl-2-buten-1-yl)-1-(methylsulfonyl)-3-piperidinyl]methanol

  • Molecular FormulaC12H23NO3S
  • Average mass261.381 Da
  • Monoisotopic mass261.139862 Da
  • ChemSpider ID29533954

More details:

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

[3-(3-Methyl-2-buten-1-yl)-1-(methylsulfonyl)-3-piperidinyl]methanol [German] [ACD/IUPAC Name]
[3-(3-Methyl-2-buten-1-yl)-1-(methylsulfonyl)-3-piperidinyl]methanol [ACD/IUPAC Name]
[3-(3-Méthyl-2-butén-1-yl)-1-(méthylsulfonyl)-3-pipéridinyl]méthanol [French] [ACD/IUPAC Name]
3-Piperidinemethanol, 3-(3-methyl-2-buten-1-yl)-1-(methylsulfonyl)- [ACD/Index Name]
[1-METHANESULFONYL-3-(3-METHYLBUT-2-EN-1-YL)PIPERIDIN-3-YL]METHANOL

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

Density: 1.2±0.1 g/cm3
Boiling Point: 382.7±34.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.0 mmHg at 25°C
Enthalpy of Vaporization: 73.0±6.0 kJ/mol
Flash Point: 185.3±25.7 °C
Index of Refraction: 1.529
Molar Refractivity: 69.5±0.4 cm3
#H bond acceptors: 4
#H bond donors: 1
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: 1.92
ACD/LogD (pH 5.5): 2.33
ACD/BCF (pH 5.5): 34.44
ACD/KOC (pH 5.5): 438.41
ACD/LogD (pH 7.4): 2.33
ACD/BCF (pH 7.4): 34.44
ACD/KOC (pH 7.4): 438.41
Polar Surface Area: 66 Å2
Polarizability: 27.5±0.5 10-24cm3
Surface Tension: 45.1±5.0 dyne/cm
Molar Volume: 225.5±5.0 cm3

Click to predict properties on the Chemicalize site


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