ChemSpider 2D Image | Cer(d18:0/18:1(11Z)) | C36H71NO3

Cer(d18:0/18:1(11Z))

  • Molecular FormulaC36H71NO3
  • Average mass565.954 Da
  • Monoisotopic mass565.543396 Da
  • ChemSpider ID24765762

  • 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)-1,3-Dihydroxy-2-octadecanyl]-11-octadecenamid [German] [ACD/IUPAC Name]
(11Z)-N-[(2S,3R)-1,3-Dihydroxy-2-octadecanyl]-11-octadecenamide [ACD/IUPAC Name]
(11Z)-N-[(2S,3R)-1,3-Dihydroxy-2-octadécanyl]-11-octadécénamide [French] [ACD/IUPAC Name]
11-Octadecenamide, N-[(1S,2R)-2-hydroxy-1-(hydroxymethyl)heptadecyl]-, (11Z)- [ACD/Index Name]
Cer(d18:0/18:1(11Z))
(11Z)-N-[(2S,3R)-1,3-dihydroxyoctadecan-2-yl]octadec-11-enamide

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

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

Density: 0.9±0.1 g/cm3
Boiling Point: 694.5±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±4.9 mmHg at 25°C
Enthalpy of Vaporization: 116.3±6.0 kJ/mol
Flash Point: 373.8±28.7 °C
Index of Refraction: 1.480
Molar Refractivity: 175.5±0.3 cm3
#H bond acceptors: 4
#H bond donors: 3
#Freely Rotating Bonds: 32
#Rule of 5 Violations: 2
ACD/LogP: 14.01
ACD/LogD (pH 5.5): 12.83
ACD/BCF (pH 5.5): 1000000.00
ACD/KOC (pH 5.5): 10000000.00
ACD/LogD (pH 7.4): 12.83
ACD/BCF (pH 7.4): 1000000.00
ACD/KOC (pH 7.4): 10000000.00
Polar Surface Area: 70 Å2
Polarizability: 69.6±0.5 10-24cm3
Surface Tension: 35.9±3.0 dyne/cm
Molar Volume: 618.1±3.0 cm3

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