ChemSpider 2D Image | 4-{[(3-Methoxypropyl)(tetradecanoyl)amino]methyl}phenyl methanesulfonate | C26H45NO5S

4-{[(3-Methoxypropyl)(tetradecanoyl)amino]methyl}phenyl methanesulfonate

  • Molecular FormulaC26H45NO5S
  • Average mass483.704 Da
  • Monoisotopic mass483.301849 Da
  • ChemSpider ID21573612

More details:






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

4-{[(3-Methoxypropyl)(tetradecanoyl)amino]methyl}phenyl methanesulfonate [ACD/IUPAC Name]
4-{[(3-Methoxypropyl)(tetradecanoyl)amino]methyl}phenyl-methansulfonat [German] [ACD/IUPAC Name]
Méthanesulfonate de 4-{[(3-méthoxypropyl)(tetradecanoyl)amino]méthyl}phényle [French] [ACD/IUPAC Name]
Tetradecanamide, N-(3-methoxypropyl)-N-[[4-[(methylsulfonyl)oxy]phenyl]methyl]- [ACD/Index Name]

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module

Density: 1.1±0.1 g/cm3
Boiling Point: 610.9±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.8 mmHg at 25°C
Enthalpy of Vaporization: 90.7±3.0 kJ/mol
Flash Point: 323.3±31.5 °C
Index of Refraction: 1.503
Molar Refractivity: 135.7±0.4 cm3
#H bond acceptors: 6
#H bond donors: 0
#Freely Rotating Bonds: 20
#Rule of 5 Violations: 1
ACD/LogP: 6.66
ACD/LogD (pH 5.5): 7.38
ACD/BCF (pH 5.5): 238983.75
ACD/KOC (pH 5.5): 246269.61
ACD/LogD (pH 7.4): 7.38
ACD/BCF (pH 7.4): 238984.02
ACD/KOC (pH 7.4): 246269.89
Polar Surface Area: 81 Å2
Polarizability: 53.8±0.5 10-24cm3
Surface Tension: 39.6±3.0 dyne/cm
Molar Volume: 458.6±3.0 cm3

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