ChemSpider 2D Image | 3-{[1-(Chloromethyl)cyclobutyl]methyl}-1-(methylsulfonyl)piperidine | C12H22ClNO2S

3-{[1-(Chloromethyl)cyclobutyl]methyl}-1-(methylsulfonyl)piperidine

  • Molecular FormulaC12H22ClNO2S
  • Average mass279.827 Da
  • Monoisotopic mass279.105988 Da
  • ChemSpider ID36214307

More details:

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

3-{[1-(Chlormethyl)cyclobutyl]methyl}-1-(methylsulfonyl)piperidin [German] [ACD/IUPAC Name]
3-{[1-(Chloromethyl)cyclobutyl]methyl}-1-(methylsulfonyl)piperidine [ACD/IUPAC Name]
3-{[1-(Chlorométhyl)cyclobutyl]méthyl}-1-(méthylsulfonyl)pipéridine [French] [ACD/IUPAC Name]
Piperidine, 3-[[1-(chloromethyl)cyclobutyl]methyl]-1-(methylsulfonyl)- [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: 390.0±34.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.9 mmHg at 25°C
Enthalpy of Vaporization: 63.9±3.0 kJ/mol
Flash Point: 189.7±25.7 °C
Index of Refraction: 1.535
Molar Refractivity: 71.0±0.4 cm3
#H bond acceptors: 3
#H bond donors: 0
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: 3.01
ACD/LogD (pH 5.5): 2.96
ACD/BCF (pH 5.5): 105.59
ACD/KOC (pH 5.5): 977.50
ACD/LogD (pH 7.4): 2.96
ACD/BCF (pH 7.4): 105.59
ACD/KOC (pH 7.4): 977.50
Polar Surface Area: 46 Å2
Polarizability: 28.2±0.5 10-24cm3
Surface Tension: 45.0±5.0 dyne/cm
Molar Volume: 228.1±5.0 cm3

Click to predict properties on the Chemicalize site


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