ChemSpider 2D Image | (2S)-2-Amino-9-octadecenoic acid | C18H35NO2

(2S)-2-Amino-9-octadecenoic acid

  • Molecular FormulaC18H35NO2
  • Average mass297.476 Da
  • Monoisotopic mass297.266785 Da
  • ChemSpider ID57536418

  • defined stereocentres - 1 of 1 defined stereocentres

More details:

Validated by Experts, Validated by Users, Non-Validated, Removed by Users

(2S)-2-Amino-9-octadecenoic acid [ACD/IUPAC Name]
(2S)-2-Amino-9-octadecensäure [German] [ACD/IUPAC Name]
9-Octadecenoic acid, 2-amino-, (2S)- [ACD/Index Name]
Acide (2S)-2-amino-9-octadécénoïque [French] [ACD/IUPAC Name]
(2S)-2-Aminooctadec-9-enoic acid
397869-84-0 [RN]

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

Density: 0.9±0.1 g/cm3
Boiling Point: 403.2±38.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.0 mmHg at 25°C
Enthalpy of Vaporization: 71.8±6.0 kJ/mol
Flash Point: 197.6±26.8 °C
Index of Refraction: 1.481
Molar Refractivity: 90.6±0.3 cm3
#H bond acceptors: 3
#H bond donors: 3
#Freely Rotating Bonds: 15
#Rule of 5 Violations: 1
ACD/LogP: 6.77
ACD/LogD (pH 5.5): 3.45
ACD/BCF (pH 5.5): 61.70
ACD/KOC (pH 5.5): 129.58
ACD/LogD (pH 7.4): 3.45
ACD/BCF (pH 7.4): 61.56
ACD/KOC (pH 7.4): 129.29
Polar Surface Area: 63 Å2
Polarizability: 35.9±0.5 10-24cm3
Surface Tension: 36.9±3.0 dyne/cm
Molar Volume: 318.0±3.0 cm3

Click to predict properties on the Chemicalize site


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