ChemSpider 2D Image | (11Z)-N-[(2S,3R,4E)-1,3-Dihydroxy-4-tetradecen-2-yl]-11-icosenamide | C34H65NO3

(11Z)-N-[(2S,3R,4E)-1,3-Dihydroxy-4-tetradecen-2-yl]-11-icosenamide

  • Molecular FormulaC34H65NO3
  • Average mass535.885 Da
  • Monoisotopic mass535.496460 Da
  • ChemSpider ID113381098

  • 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

(11Z)-N-[(2S,3R,4E)-1,3-Dihydroxy-4-tetradecen-2-yl]-11-icosenamid [German] [ACD/IUPAC Name]
(11Z)-N-[(2S,3R,4E)-1,3-Dihydroxy-4-tetradecen-2-yl]-11-icosenamide [ACD/IUPAC Name]
(11Z)-N-[(2S,3R,4E)-1,3-Dihydroxy-4-tétradécén-2-yl]-11-icosénamide [French] [ACD/IUPAC Name]
11-Eicosenamide, N-[(1S,2R,3E)-2-hydroxy-1-(hydroxymethyl)-3-tridecen-1-yl]-, (11Z)- [ACD/Index Name]
Cer(d14:1(4E)/20:1(11Z))
Cer(d14:1/20:1)
Cer[NS]
N-(11Z-eicosenoyl)-tetradecasphing-4-enine

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

Density: 0.9±0.1 g/cm3
Boiling Point: 675.2±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±4.7 mmHg at 25°C
Enthalpy of Vaporization: 113.4±6.0 kJ/mol
Flash Point: 362.1±31.5 °C
Index of Refraction: 1.487
Molar Refractivity: 166.3±0.3 cm3
#H bond acceptors: 4
#H bond donors: 3
#Freely Rotating Bonds: 29
#Rule of 5 Violations: 2
ACD/LogP: 12.82
ACD/LogD (pH 5.5): 11.86
ACD/BCF (pH 5.5): 1000000.00
ACD/KOC (pH 5.5): 10000000.00
ACD/LogD (pH 7.4): 11.86
ACD/BCF (pH 7.4): 1000000.00
ACD/KOC (pH 7.4): 10000000.00
Polar Surface Area: 70 Å2
Polarizability: 65.9±0.5 10-24cm3
Surface Tension: 36.3±3.0 dyne/cm
Molar Volume: 578.7±3.0 cm3

Click to predict properties on the Chemicalize site


Advertisement