ChemSpider 2D Image | hexadecasphing-4-enine | C16H33NO2

hexadecasphing-4-enine

  • Molecular FormulaC16H33NO2
  • Average mass271.439 Da
  • Monoisotopic mass271.251129 Da
  • ChemSpider ID28533427

  • 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)-2-Amino-4-hexadecen-1,3-diol [German] [ACD/IUPAC Name]
(2S,3R,4E)-2-Amino-4-hexadecene-1,3-diol [ACD/IUPAC Name]
(2S,3R,4E)-2-Amino-4-hexadécène-1,3-diol [French] [ACD/IUPAC Name]
4-Hexadecene-1,3-diol, 2-amino-, (2S,3R,4E)- [ACD/Index Name]
hexadecasphing-4-enine
(2S,3R,4E)-2-aminohexadec-4-ene-1,3-diol
(E,2S,3R)-2-aminohexadec-4-ene-1,3-diol
6982-09-8 [RN]
C16 sphingosine
C16-Sphingosine
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Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

Density: 0.9±0.1 g/cm3
Boiling Point: 419.6±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.2 mmHg at 25°C
Enthalpy of Vaporization: 77.8±6.0 kJ/mol
Flash Point: 207.6±28.7 °C
Index of Refraction: 1.491
Molar Refractivity: 82.8±0.3 cm3
#H bond acceptors: 3
#H bond donors: 4
#Freely Rotating Bonds: 13
#Rule of 5 Violations: 1
ACD/LogP: 5.34
ACD/LogD (pH 5.5): 1.33
ACD/BCF (pH 5.5): 1.14
ACD/KOC (pH 5.5): 5.32
ACD/LogD (pH 7.4): 2.51
ACD/BCF (pH 7.4): 17.43
ACD/KOC (pH 7.4): 81.52
Polar Surface Area: 66 Å2
Polarizability: 32.8±0.5 10-24cm3
Surface Tension: 38.8±3.0 dyne/cm
Molar Volume: 285.7±3.0 cm3

Click to predict properties on the Chemicalize site


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