Found 10 results

Search term: MF = 'C_{34}H_{65}NO_{4}'
ChemSpider 2D Image | (1Z,2S)-N-[(2S,3R,4E,8E)-1,3-Dihydroxy-4,8-octadecadien-2-yl]-2-hydroxyhexadecanimidic acid | C34H65NO4

(1Z,2S)-N-[(2S,3R,4E,8E)-1,3-Dihydroxy-4,8-octadecadien-2-yl]-2-hydroxyhexadecanimidic acid

  • Molecular FormulaC34H65NO4
  • Average mass551.884 Da
  • Monoisotopic mass551.491333 Da
  • ChemSpider ID58837405

  • Double-bond stereo - Double-bond stereo

    defined stereocentres - 3 of 3 defined stereocentres

More details:

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

(1Z,2S)-N-[(2S,3R,4E,8E)-1,3-Dihydroxy-4,8-octadecadien-2-yl]-2-hydroxyhexadecanimidic acid [ACD/IUPAC Name]
(1Z,2S)-N-[(2S,3R,4E,8E)-1,3-Dihydroxy-4,8-octadecadien-2-yl]-2-hydroxyhexadecanimidsäure [German] [ACD/IUPAC Name]
Acide (1Z,2S)-N-[(2S,3R,4E,8E)-1,3-dihydroxy-4,8-octadécadién-2-yl]-2-hydroxyhexadécanimidique [French] [ACD/IUPAC Name]
Hexadecanimidic acid, 2-hydroxy-N-[(1S,2R,3E,7E)-2-hydroxy-1-(hydroxymethyl)-3,7-heptadecadien-1-yl]-, (1Z,2S)- [ACD/Index Name]
N-(2-hydroxyhexadecanoyl)-4,8-sphingadienine
N-(2-hydroxyhexadecanoyl)-sphinga-4,8-dienine
4,8-sphingadienine-2-hydroxy-16:0, ceramide

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

Density: 1.0±0.1 g/cm3
Boiling Point: 685.9±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±4.8 mmHg at 25°C
Enthalpy of Vaporization: 115.0±6.0 kJ/mol
Flash Point: 475.7±23.5 °C
Index of Refraction: 1.491
Molar Refractivity: 165.3±0.5 cm3
#H bond acceptors: 5
#H bond donors: 4
#Freely Rotating Bonds: 29
#Rule of 5 Violations: 2
ACD/LogP: 12.83
ACD/LogD (pH 5.5): 10.71
ACD/BCF (pH 5.5): 1000000.00
ACD/KOC (pH 5.5): 8657248.00
ACD/LogD (pH 7.4): 10.71
ACD/BCF (pH 7.4): 1000000.00
ACD/KOC (pH 7.4): 8556380.00
Polar Surface Area: 93 Å2
Polarizability: 65.5±0.5 10-24cm3
Surface Tension: 35.5±7.0 dyne/cm
Molar Volume: 571.3±7.0 cm3

Click to predict properties on the Chemicalize site


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