ChemSpider 2D Image | N-[(2R,3R,4S)-1,2,3-Trihydroxy-4-octadecanyl]octanamide | C26H53NO4

N-[(2R,3R,4S)-1,2,3-Trihydroxy-4-octadecanyl]octanamide

  • Molecular FormulaC26H53NO4
  • Average mass443.703 Da
  • Monoisotopic mass443.397461 Da
  • ChemSpider ID26998607

  • defined stereocentres - 3 of 3 defined stereocentres

More details:

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

N-[(2R,3R,4S)-1,2,3-Trihydroxy-4-octadecanyl]octanamid [German] [ACD/IUPAC Name]
N-[(2R,3R,4S)-1,2,3-Trihydroxy-4-octadecanyl]octanamide [ACD/IUPAC Name]
N-[(2R,3R,4S)-1,2,3-Trihydroxy-4-octadécanyl]octanamide [French] [ACD/IUPAC Name]
Octanamide, N-[(1S)-1-[(1R,2R)-1,2,3-trihydroxypropyl]pentadecyl]- [ACD/Index Name]
N-((2R,3R,4S)-1,2,3-Trihydroxyoctadecan-4-yl)octanamide

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

Density: 1.0±0.1 g/cm3
Boiling Point: 627.6±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±4.2 mmHg at 25°C
Enthalpy of Vaporization: 106.4±6.0 kJ/mol
Flash Point: 333.3±31.5 °C
Index of Refraction: 1.483
Molar Refractivity: 130.6±0.3 cm3
#H bond acceptors: 5
#H bond donors: 4
#Freely Rotating Bonds: 23
#Rule of 5 Violations: 1
ACD/LogP: 7.84
ACD/LogD (pH 5.5): 8.40
ACD/BCF (pH 5.5): 1000000.00
ACD/KOC (pH 5.5): 879158.13
ACD/LogD (pH 7.4): 8.40
ACD/BCF (pH 7.4): 1000000.00
ACD/KOC (pH 7.4): 879157.19
Polar Surface Area: 90 Å2
Polarizability: 51.8±0.5 10-24cm3
Surface Tension: 38.9±3.0 dyne/cm
Molar Volume: 457.3±3.0 cm3

Click to predict properties on the Chemicalize site


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