ChemSpider 2D Image | (2S,3R,4E)-1,3-Dihydroxy-4-octadecen-2-aminium | C18H38NO2

(2S,3R,4E)-1,3-Dihydroxy-4-octadecen-2-aminium

  • Molecular FormulaC18H38NO2
  • Average mass300.499 Da
  • Monoisotopic mass300.289703 Da
  • ChemSpider ID24929763
  • Charge - Charge

    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

(2S,3R,4E)-1,3-Dihydroxy-4-octadecen-2-aminium [German] [ACD/IUPAC Name]
(2S,3R,4E)-1,3-Dihydroxy-4-octadecen-2-aminium [ACD/IUPAC Name]
(2S,3R,4E)-1,3-Dihydroxy-4-octadécén-2-aminium [French] [ACD/IUPAC Name]
4-Octadecene-1,3-diol, 2-amino-, conjugate acid, (2S,3R,4E)- [ACD/Index Name]
(2S,3R,4E)-1,3-dihydroxyoctadec-4-en-2-aminium
octadecasphing-4-enine
sphing-4-enine
Sphingosine [Wiki]
sphingosine(1+)
  • Miscellaneous

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module

Density:
Boiling Point: 445.9±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.4 mmHg at 25°C
Enthalpy of Vaporization: 81.2±6.0 kJ/mol
Flash Point: 223.5±28.7 °C
Index of Refraction:
Molar Refractivity:
#H bond acceptors: 3
#H bond donors: 4
#Freely Rotating Bonds: 15
#Rule of 5 Violations: 1
ACD/LogP: 6.40
ACD/LogD (pH 5.5): 2.45
ACD/BCF (pH 5.5): 8.19
ACD/KOC (pH 5.5): 21.85
ACD/LogD (pH 7.4): 3.64
ACD/BCF (pH 7.4): 125.49
ACD/KOC (pH 7.4): 334.94
Polar Surface Area: 68 Å2
Polarizability:
Surface Tension:
Molar Volume:

Click to predict properties on the Chemicalize site






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