ChemSpider 2D Image | (2S,3R,9Z)-2-Amino-1-phenyl-9-tetradecen-3-ol | C20H33NO

(2S,3R,9Z)-2-Amino-1-phenyl-9-tetradecen-3-ol

  • Molecular FormulaC20H33NO
  • Average mass303.482 Da
  • Monoisotopic mass303.256226 Da
  • ChemSpider ID40256823

  • 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-1-phenyl-9-tetradecen-3-ol [German] [ACD/IUPAC Name]
(2S,3R,9Z)-2-Amino-1-phenyl-9-tetradecen-3-ol [ACD/IUPAC Name]
(2S,3R,9Z)-2-Amino-1-phényl-9-tétradécén-3-ol [French] [ACD/IUPAC Name]
Benzenepropanol, β-amino-α-[(6Z)-6-undecen-1-yl]-, (αR,βS)- [ACD/Index Name]

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

Density: 1.0±0.1 g/cm3
Boiling Point: 449.7±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.2 mmHg at 25°C
Enthalpy of Vaporization: 74.7±3.0 kJ/mol
Flash Point: 225.7±28.7 °C
Index of Refraction: 1.523
Molar Refractivity: 96.4±0.3 cm3
#H bond acceptors: 2
#H bond donors: 3
#Freely Rotating Bonds: 12
#Rule of 5 Violations: 1
ACD/LogP: 5.92
ACD/LogD (pH 5.5): 1.73
ACD/BCF (pH 5.5): 2.20
ACD/KOC (pH 5.5): 8.09
ACD/LogD (pH 7.4): 2.17
ACD/BCF (pH 7.4): 6.07
ACD/KOC (pH 7.4): 22.36
Polar Surface Area: 46 Å2
Polarizability: 38.2±0.5 10-24cm3
Surface Tension: 38.9±3.0 dyne/cm
Molar Volume: 315.9±3.0 cm3

Click to predict properties on the Chemicalize site


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