ChemSpider 2D Image | C2 Ceramide (d14:1/2:0) | C16H31NO3

C2 Ceramide (d14:1/2:0)

  • Molecular FormulaC16H31NO3
  • Average mass285.422 Da
  • Monoisotopic mass285.230408 Da
  • ChemSpider ID68004176

  • 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

2097561-20-9 [RN]
Acetamide, N-[(1S,2R,3E)-2-hydroxy-1-(hydroxymethyl)-3-tridecen-1-yl]- [ACD/Index Name]
C2 Ceramide (d14:1/2:0)
N-[(2S,3R,4E)-1,3-Dihydroxy-4-tetradecen-2-yl]acetamid [German] [ACD/IUPAC Name]
N-[(2S,3R,4E)-1,3-Dihydroxy-4-tetradecen-2-yl]acetamide [ACD/IUPAC Name]
N-[(2S,3R,4E)-1,3-Dihydroxy-4-tétradécén-2-yl]acétamide [French] [ACD/IUPAC Name]
N-[(1S,2R,3E)-2-hydroxy-1-(hydroxymethyl)-3-tridecen-1-yl]-acetamide
N-[(E,2S,3R)-1,3-dihydroxytetradec-4-en-2-yl]acetamide

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

Density: 1.0±0.1 g/cm3
Boiling Point: 489.9±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.8 mmHg at 25°C
Enthalpy of Vaporization: 87.1±6.0 kJ/mol
Flash Point: 250.1±28.7 °C
Index of Refraction: 1.487
Molar Refractivity: 82.8±0.3 cm3
#H bond acceptors: 4
#H bond donors: 3
#Freely Rotating Bonds: 12
#Rule of 5 Violations: 0
ACD/LogP: 3.77
ACD/LogD (pH 5.5): 3.87
ACD/BCF (pH 5.5): 513.23
ACD/KOC (pH 5.5): 3031.40
ACD/LogD (pH 7.4): 3.87
ACD/BCF (pH 7.4): 513.23
ACD/KOC (pH 7.4): 3031.39
Polar Surface Area: 70 Å2
Polarizability: 32.8±0.5 10-24cm3
Surface Tension: 38.5±3.0 dyne/cm
Molar Volume: 288.0±3.0 cm3

Click to predict properties on the Chemicalize site


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