ChemSpider 2D Image | 3-{[Dodecanoyl(2-furylmethyl)amino]methyl}phenyl ethanesulfonate | C26H39NO5S

3-{[Dodecanoyl(2-furylmethyl)amino]methyl}phenyl ethanesulfonate

  • Molecular FormulaC26H39NO5S
  • Average mass477.657 Da
  • Monoisotopic mass477.254883 Da
  • ChemSpider ID22572496

More details:

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

3-{[Dodecanoyl(2-furylmethyl)amino]methyl}phenyl ethanesulfonate [ACD/IUPAC Name]
3-{[Dodecanoyl(2-furylmethyl)amino]methyl}phenyl-ethansulfonat [German] [ACD/IUPAC Name]
Éthanesulfonate de 3-{[dodecanoyl(2-furylméthyl)amino]méthyl}phényle [French] [ACD/IUPAC Name]
Ethanesulfonic acid, 3-[[(2-furanylmethyl)(1-oxododecyl)amino]methyl]phenyl ester [ACD/Index Name]

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

Density: 1.1±0.1 g/cm3
Boiling Point: 621.4±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.8 mmHg at 25°C
Enthalpy of Vaporization: 92.1±3.0 kJ/mol
Flash Point: 329.6±31.5 °C
Index of Refraction: 1.529
Molar Refractivity: 132.6±0.4 cm3
#H bond acceptors: 6
#H bond donors: 0
#Freely Rotating Bonds: 17
#Rule of 5 Violations: 1
ACD/LogP: 6.80
ACD/LogD (pH 5.5): 7.47
ACD/BCF (pH 5.5): 278704.00
ACD/KOC (pH 5.5): 274921.06
ACD/LogD (pH 7.4): 7.47
ACD/BCF (pH 7.4): 278704.00
ACD/KOC (pH 7.4): 274921.06
Polar Surface Area: 85 Å2
Polarizability: 52.6±0.5 10-24cm3
Surface Tension: 42.6±3.0 dyne/cm
Molar Volume: 429.7±3.0 cm3

Click to predict properties on the Chemicalize site


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