ChemSpider 2D Image | (2S,3R,9Z)-2-Amino-9-hexadecen-3-ol | C16H33NO

(2S,3R,9Z)-2-Amino-9-hexadecen-3-ol

  • Molecular FormulaC16H33NO
  • Average mass255.439 Da
  • Monoisotopic mass255.256210 Da
  • ChemSpider ID107561923

  • 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,9Z)-2-Amino-9-hexadecen-3-ol [German] [ACD/IUPAC Name]
(2S,3R,9Z)-2-Amino-9-hexadecen-3-ol [ACD/IUPAC Name]
(2S,3R,9Z)-2-Amino-9-hexadécén-3-ol [French] [ACD/IUPAC Name]
9-Hexadecen-3-ol, 2-amino-, (2S,3R,9Z)- [ACD/Index Name]
(Z,2S,3R)-2-aminohexadec-9-en-3-ol
1-deoxy-9Z-hexadecasphingenine
350484-99-0 [RN]
Obscuraminol D

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

Density: 0.9±0.1 g/cm3
Boiling Point: 375.3±35.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.9 mmHg at 25°C
Enthalpy of Vaporization: 72.1±6.0 kJ/mol
Flash Point: 180.8±25.9 °C
Index of Refraction: 1.476
Molar Refractivity: 81.2±0.3 cm3
#H bond acceptors: 2
#H bond donors: 3
#Freely Rotating Bonds: 12
#Rule of 5 Violations: 1
ACD/LogP: 5.24
ACD/LogD (pH 5.5): 1.86
ACD/BCF (pH 5.5): 2.75
ACD/KOC (pH 5.5): 9.48
ACD/LogD (pH 7.4): 2.22
ACD/BCF (pH 7.4): 6.37
ACD/KOC (pH 7.4): 21.98
Polar Surface Area: 46 Å2
Polarizability: 32.2±0.5 10-24cm3
Surface Tension: 34.1±3.0 dyne/cm
Molar Volume: 288.2±3.0 cm3

Click to predict properties on the Chemicalize site


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