ChemSpider 2D Image | CERAMIDE 5 | C42H83NO4

CERAMIDE 5

  • Molecular FormulaC42H83NO4
  • Average mass666.113 Da
  • Monoisotopic mass665.632202 Da
  • ChemSpider ID30786074

  • Double-bond stereo - Double-bond stereo

    defined stereocentres - 2 of 3 defined stereocentres

More details:

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

288072-63-9 [RN]
CERAMIDE 5
N-[(2S,3R,4E)-1,3-Dihydroxy-4-octadecen-2-yl]-2-hydroxytetracosanamid [German] [ACD/IUPAC Name]
N-[(2S,3R,4E)-1,3-Dihydroxy-4-octadecen-2-yl]-2-hydroxytetracosanamide [ACD/IUPAC Name]
N-[(2S,3R,4E)-1,3-Dihydroxy-4-octadécén-2-yl]-2-hydroxytétracosanamide [French] [ACD/IUPAC Name]
Tetracosanamide, 2-hydroxy-N-[(1S,2R,3E)-2-hydroxy-1-(hydroxymethyl)-3-heptadecen-1-yl]- [ACD/Index Name]
2-OH-C24 :0 Ceramide
Cer(d18:1(4E)/24:0(2OH))
Cer(d18:1/24:0(2OH))
Cer[AS]
More...

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

7848GX36YB [DBID]
UNII:7848GX36YB [DBID]

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

Density: 0.9±0.1 g/cm3
Boiling Point: 774.5±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±6.0 mmHg at 25°C
Enthalpy of Vaporization: 128.5±6.0 kJ/mol
Flash Point: 422.2±32.9 °C
Index of Refraction: 1.485
Molar Refractivity: 204.8±0.3 cm3
#H bond acceptors: 5
#H bond donors: 4
#Freely Rotating Bonds: 38
#Rule of 5 Violations: 2
ACD/LogP: 17.08
ACD/LogD (pH 5.5): 15.05
ACD/BCF (pH 5.5): 1000000.00
ACD/KOC (pH 5.5): 10000000.00
ACD/LogD (pH 7.4): 15.05
ACD/BCF (pH 7.4): 1000000.00
ACD/KOC (pH 7.4): 10000000.00
Polar Surface Area: 90 Å2
Polarizability: 81.2±0.5 10-24cm3
Surface Tension: 37.2±3.0 dyne/cm
Molar Volume: 715.0±3.0 cm3

Click to predict properties on the Chemicalize site


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