Found 129 results

Search term: MF = 'C_{21}H_{41}NO_{3}'
ChemSpider 2D Image | N-[(2S,3R,4E)-1,3-Dihydroxy-4-octadecen-2-yl]propanamide | C21H41NO3

N-[(2S,3R,4E)-1,3-Dihydroxy-4-octadecen-2-yl]propanamide

  • Molecular FormulaC21H41NO3
  • Average mass355.555 Da
  • Monoisotopic mass355.308655 Da
  • ChemSpider ID48058319

  • 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

N-[(2S,3R,4E)-1,3-Dihydroxy-4-octadecen-2-yl]propanamid [German] [ACD/IUPAC Name]
N-[(2S,3R,4E)-1,3-Dihydroxy-4-octadecen-2-yl]propanamide [ACD/IUPAC Name]
N-[(2S,3R,4E)-1,3-Dihydroxy-4-octadécén-2-yl]propanamide [French] [ACD/IUPAC Name]
Propanamide, N-[(1S,2R,3E)-2-hydroxy-1-(hydroxymethyl)-3-heptadecen-1-yl]- [ACD/Index Name]
362678-52-2 [RN]
c3 ceramide
N-((2S,3R,E)-1,3-dihydroxyoctadec-4-en-2-yl)propionamide

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

    Density: 1.0±0.1 g/cm3
    Boiling Point: 543.0±50.0 °C at 760 mmHg
    Vapour Pressure: 0.0±3.3 mmHg at 25°C
    Enthalpy of Vaporization: 94.4±6.0 kJ/mol
    Flash Point: 282.2±30.1 °C
    Index of Refraction: 1.484
    Molar Refractivity: 106.0±0.3 cm3
    #H bond acceptors: 4
    #H bond donors: 3
    #Freely Rotating Bonds: 17
    #Rule of 5 Violations: 1
    ACD/LogP: 6.43
    ACD/LogD (pH 5.5): 5.95
    ACD/BCF (pH 5.5): 19543.75
    ACD/KOC (pH 5.5): 41028.91
    ACD/LogD (pH 7.4): 5.95
    ACD/BCF (pH 7.4): 19543.73
    ACD/KOC (pH 7.4): 41028.87
    Polar Surface Area: 70 Å2
    Polarizability: 42.0±0.5 10-24cm3
    Surface Tension: 37.4±3.0 dyne/cm
    Molar Volume: 370.5±3.0 cm3

    Click to predict properties on the Chemicalize site


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