ChemSpider 2D Image | 2-[(2E)-2-Buten-1-ylsulfinyl]-1-(4-methyl-1-piperidinyl)-1-propanone | C13H23NO2S

2-[(2E)-2-Buten-1-ylsulfinyl]-1-(4-methyl-1-piperidinyl)-1-propanone

  • Molecular FormulaC13H23NO2S
  • Average mass257.392 Da
  • Monoisotopic mass257.144958 Da
  • ChemSpider ID35150304

  • Double-bond stereo - Double-bond stereo

More details:

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

1-Propanone, 2-[(2E)-2-buten-1-ylsulfinyl]-1-(4-methyl-1-piperidinyl)- [ACD/Index Name]
2-[(2E)-2-Buten-1-ylsulfinyl]-1-(4-methyl-1-piperidinyl)-1-propanon [German] [ACD/IUPAC Name]
2-[(2E)-2-Buten-1-ylsulfinyl]-1-(4-methyl-1-piperidinyl)-1-propanone [ACD/IUPAC Name]
2-[(2E)-2-Butén-1-ylsulfinyl]-1-(4-méthyl-1-pipéridinyl)-1-propanone [French] [ACD/IUPAC Name]
2-[(2E)-BUT-2-ENE-1-SULFINYL]-1-(4-METHYLPIPERIDIN-1-YL)PROPAN-1-ONE

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

Density: 1.1±0.1 g/cm3
Boiling Point: 445.6±38.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.1 mmHg at 25°C
Enthalpy of Vaporization: 70.4±3.0 kJ/mol
Flash Point: 223.3±26.8 °C
Index of Refraction: 1.530
Molar Refractivity: 72.6±0.3 cm3
#H bond acceptors: 3
#H bond donors: 0
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: 1.75
ACD/LogD (pH 5.5): 1.94
ACD/BCF (pH 5.5): 17.59
ACD/KOC (pH 5.5): 271.05
ACD/LogD (pH 7.4): 1.94
ACD/BCF (pH 7.4): 17.59
ACD/KOC (pH 7.4): 271.05
Polar Surface Area: 57 Å2
Polarizability: 28.8±0.5 10-24cm3
Surface Tension: 45.3±3.0 dyne/cm
Molar Volume: 234.8±3.0 cm3

Click to predict properties on the Chemicalize site


Advertisement