Found 16 results

Search term: MF = 'C_{44}H_{87}NO_{5}'
ChemSpider 2D Image | (2R,4E)-2-Hydroxy-N-[(2S,3S,4R)-1,3,4-trihydroxy-16-methyl-2-octadecanyl]-4-pentacosenamide | C44H87NO5

(2R,4E)-2-Hydroxy-N-[(2S,3S,4R)-1,3,4-trihydroxy-16-methyl-2-octadecanyl]-4-pentacosenamide

  • Molecular FormulaC44H87NO5
  • Average mass710.165 Da
  • Monoisotopic mass709.658447 Da
  • ChemSpider ID29213181

  • Double-bond stereo - Double-bond stereo

    defined stereocentres - 4 of 5 defined stereocentres

More details:

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

(2R,4E)-2-Hydroxy-N-[(2S,3S,4R)-1,3,4-trihydroxy-16-methyl-2-octadecanyl]-4-pentacosenamid [German] [ACD/IUPAC Name]
(2R,4E)-2-Hydroxy-N-[(2S,3S,4R)-1,3,4-trihydroxy-16-methyl-2-octadecanyl]-4-pentacosenamide [ACD/IUPAC Name]
(2R,4E)-2-Hydroxy-N-[(2S,3S,4R)-1,3,4-trihydroxy-16-méthyl-2-octadécanyl]-4-pentacosénamide [French] [ACD/IUPAC Name]
4-Pentacosenamide, N-[(1S,2S,3R)-2,3-dihydroxy-1-(hydroxymethyl)-15-methylheptadecyl]-2-hydroxy-, (2R,4E)- [ACD/Index 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: 812.8±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±6.6 mmHg at 25°C
Enthalpy of Vaporization: 134.5±6.0 kJ/mol
Flash Point: 445.4±34.3 °C
Index of Refraction: 1.489
Molar Refractivity: 215.5±0.3 cm3
#H bond acceptors: 6
#H bond donors: 5
#Freely Rotating Bonds: 39
#Rule of 5 Violations: 3
ACD/LogP: 17.05
ACD/LogD (pH 5.5): 14.13
ACD/BCF (pH 5.5): 1000000.00
ACD/KOC (pH 5.5): 10000000.00
ACD/LogD (pH 7.4): 14.13
ACD/BCF (pH 7.4): 1000000.00
ACD/KOC (pH 7.4): 10000000.00
Polar Surface Area: 110 Å2
Polarizability: 85.4±0.5 10-24cm3
Surface Tension: 38.3±3.0 dyne/cm
Molar Volume: 746.3±3.0 cm3

Click to predict properties on the Chemicalize site


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