ChemSpider 2D Image | 16-Sulfanylhexadecyl benzoate | C23H38O2S

16-Sulfanylhexadecyl benzoate

  • Molecular FormulaC23H38O2S
  • Average mass378.612 Da
  • Monoisotopic mass378.259247 Da
  • ChemSpider ID57494743

More details:

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

16-Sulfanylhexadecyl benzoate [ACD/IUPAC Name]
16-Sulfanylhexadecyl-benzoat [German] [ACD/IUPAC Name]
1-Hexadecanol, 16-mercapto-, benzoate [ACD/Index Name]
Benzoate de 16-sulfanylhexadécyle [French] [ACD/IUPAC Name]

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

Density: 1.0±0.1 g/cm3
Boiling Point: 479.8±18.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.2 mmHg at 25°C
Enthalpy of Vaporization: 74.4±3.0 kJ/mol
Flash Point: 326.9±9.1 °C
Index of Refraction: 1.505
Molar Refractivity: 115.4±0.3 cm3
#H bond acceptors: 2
#H bond donors: 0
#Freely Rotating Bonds: 18
#Rule of 5 Violations: 1
ACD/LogP: 9.60
ACD/LogD (pH 5.5): 8.26
ACD/BCF (pH 5.5): 1000000.00
ACD/KOC (pH 5.5): 738488.69
ACD/LogD (pH 7.4): 8.26
ACD/BCF (pH 7.4): 1000000.00
ACD/KOC (pH 7.4): 737900.25
Polar Surface Area: 65 Å2
Polarizability: 45.8±0.5 10-24cm3
Surface Tension: 37.2±3.0 dyne/cm
Molar Volume: 389.0±3.0 cm3

Click to predict properties on the Chemicalize site


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