ChemSpider 2D Image | (2S,3S,5E)-2-Acetamido-5-tetradecen-3-yl acetate | C18H33NO3

(2S,3S,5E)-2-Acetamido-5-tetradecen-3-yl acetate

  • Molecular FormulaC18H33NO3
  • Average mass311.460 Da
  • Monoisotopic mass311.246033 Da
  • ChemSpider ID57641808
  • Double-bond stereo - Double-bond stereo

    defined stereocentres - 2 of 2 defined stereocentres


More details:






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

(2S,3S,5E)-2-Acetamido-5-tetradecen-3-yl acetate [ACD/IUPAC Name]
(2S,3S,5E)-2-Acetamido-5-tetradecen-3-yl-acetat [German] [ACD/IUPAC Name]
Acetamide, N-[(1S,2S,4E)-2-(acetyloxy)-1-methyl-4-tridecen-1-yl]- [ACD/Index Name]
Acétate de (2S,3S,5E)-2-acétamido-5-tétradécén-3-yle [French] [ACD/IUPAC Name]
181523-11-5 [RN]
2-acetamido-3-acetoxy-5-tetradecene

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

Density: 0.9±0.1 g/cm3
Boiling Point: 450.2±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.1 mmHg at 25°C
Enthalpy of Vaporization: 70.9±3.0 kJ/mol
Flash Point: 226.1±28.7 °C
Index of Refraction: 1.463
Molar Refractivity: 90.8±0.3 cm3
#H bond acceptors: 4
#H bond donors: 1
#Freely Rotating Bonds: 13
#Rule of 5 Violations: 0
ACD/LogP: 4.93
ACD/LogD (pH 5.5): 5.09
ACD/BCF (pH 5.5): 4378.61
ACD/KOC (pH 5.5): 14062.46
ACD/LogD (pH 7.4): 5.09
ACD/BCF (pH 7.4): 4378.61
ACD/KOC (pH 7.4): 14062.47
Polar Surface Area: 55 Å2
Polarizability: 36.0±0.5 10-24cm3
Surface Tension: 32.7±3.0 dyne/cm
Molar Volume: 329.4±3.0 cm3

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