ChemSpider 2D Image | (2S,3R,4E)-2-Amino-4-octadecen-3-ol | C18H37NO

(2S,3R,4E)-2-Amino-4-octadecen-3-ol

  • Molecular FormulaC18H37NO
  • Average mass283.492 Da
  • Monoisotopic mass283.287506 Da
  • ChemSpider ID67154653

  • 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-octadecen-3-ol [German] [ACD/IUPAC Name]
(2S,3R,4E)-2-Amino-4-octadecen-3-ol [ACD/IUPAC Name]
(2S,3R,4E)-2-Amino-4-octadécén-3-ol [French] [ACD/IUPAC Name]
4-Octadecen-3-ol, 2-amino-, (2S,3R,4E)- [ACD/Index Name]
deoxysphingosine

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

Density: 0.9±0.1 g/cm3
Boiling Point: 404.4±33.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.1 mmHg at 25°C
Enthalpy of Vaporization: 75.8±6.0 kJ/mol
Flash Point: 198.3±25.4 °C
Index of Refraction: 1.475
Molar Refractivity: 90.5±0.3 cm3
#H bond acceptors: 2
#H bond donors: 3
#Freely Rotating Bonds: 14
#Rule of 5 Violations: 1
ACD/LogP: 6.84
ACD/LogD (pH 5.5): 3.01
ACD/BCF (pH 5.5): 21.34
ACD/KOC (pH 5.5): 42.81
ACD/LogD (pH 7.4): 4.10
ACD/BCF (pH 7.4): 263.30
ACD/KOC (pH 7.4): 528.11
Polar Surface Area: 46 Å2
Polarizability: 35.9±0.5 10-24cm3
Surface Tension: 34.1±3.0 dyne/cm
Molar Volume: 321.2±3.0 cm3

Click to predict properties on the Chemicalize site


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