ChemSpider 2D Image | N,N-dimethyl Sphingosine (d17:1) | C19H39NO2

N,N-dimethyl Sphingosine (d17:1)

  • Molecular FormulaC19H39NO2
  • Average mass313.518 Da
  • Monoisotopic mass313.298065 Da
  • ChemSpider ID68003992

  • 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-(Dimethylamino)-4-heptadecen-1,3-diol [German] [ACD/IUPAC Name]
(2S,3R,4E)-2-(Dimethylamino)-4-heptadecene-1,3-diol [ACD/IUPAC Name]
(2S,3R,4E)-2-(Diméthylamino)-4-heptadécène-1,3-diol [French] [ACD/IUPAC Name]
474943-92-5 [RN]
4-Heptadecene-1,3-diol, 2-(dimethylamino)-, (2S,3R,4E)- [ACD/Index Name]
N,N-dimethyl Sphingosine (d17:1)
2S-(dimethylamino)-4E-heptadecene-1,3R-diol
Dimethyl Sphingosine (d17:1)

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

Density: 0.9±0.1 g/cm3
Boiling Point: 433.8±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.4 mmHg at 25°C
Enthalpy of Vaporization: 79.6±6.0 kJ/mol
Flash Point: 181.0±27.4 °C
Index of Refraction: 1.483
Molar Refractivity: 96.8±0.3 cm3
#H bond acceptors: 3
#H bond donors: 2
#Freely Rotating Bonds: 15
#Rule of 5 Violations: 1
ACD/LogP: 7.11
ACD/LogD (pH 5.5): 3.14
ACD/BCF (pH 5.5): 39.89
ACD/KOC (pH 5.5): 106.06
ACD/LogD (pH 7.4): 4.85
ACD/BCF (pH 7.4): 2022.31
ACD/KOC (pH 7.4): 5377.38
Polar Surface Area: 44 Å2
Polarizability: 38.4±0.5 10-24cm3
Surface Tension: 35.9±3.0 dyne/cm
Molar Volume: 338.8±3.0 cm3

Click to predict properties on the Chemicalize site


Advertisement