ChemSpider 2D Image | 22-Sulfanyl-1-docosanol | C22H46OS

22-Sulfanyl-1-docosanol

  • Molecular FormulaC22H46OS
  • Average mass358.665 Da
  • Monoisotopic mass358.326935 Da
  • ChemSpider ID28682300

More details:

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

1-Docosanol, 22-mercapto- [ACD/Index Name]
22-Sulfanyl-1-docosanol [German] [ACD/IUPAC Name]
22-Sulfanyl-1-docosanol [ACD/IUPAC Name]
22-Sulfanyl-1-docosanol [French] [ACD/IUPAC Name]
137057-24-0 [RN]
22-SULFANYLDOCOSAN-1-OL

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

Density: 0.9±0.1 g/cm3
Boiling Point: 465.4±18.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.6 mmHg at 25°C
Enthalpy of Vaporization: 83.8±6.0 kJ/mol
Flash Point: 235.3±21.2 °C
Index of Refraction: 1.474
Molar Refractivity: 113.4±0.3 cm3
#H bond acceptors: 1
#H bond donors: 1
#Freely Rotating Bonds: 21
#Rule of 5 Violations: 1
ACD/LogP: 9.87
ACD/LogD (pH 5.5): 8.80
ACD/BCF (pH 5.5): 1000000.00
ACD/KOC (pH 5.5): 1450451.88
ACD/LogD (pH 7.4): 8.80
ACD/BCF (pH 7.4): 1000000.00
ACD/KOC (pH 7.4): 1449296.13
Polar Surface Area: 59 Å2
Polarizability: 45.0±0.5 10-24cm3
Surface Tension: 34.3±3.0 dyne/cm
Molar Volume: 403.2±3.0 cm3

Click to predict properties on the Chemicalize site


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