ChemSpider 2D Image | (5E)-5-Nitro-5-octadecenoic acid | C18H33NO4

(5E)-5-Nitro-5-octadecenoic acid

  • Molecular FormulaC18H33NO4
  • Average mass327.459 Da
  • Monoisotopic mass327.240967 Da
  • ChemSpider ID24627032

  • Double-bond stereo - Double-bond stereo

More details:

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

(5E)-5-Nitro-5-octadecenoic acid [ACD/IUPAC Name]
(5E)-5-Nitro-5-octadecensäure [German] [ACD/IUPAC Name]
5-Octadecenoic acid, 5-nitro-, (5E)- [ACD/Index Name]
Acide (5E)-5-nitro-5-octadécénoïque [French] [ACD/IUPAC 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: 477.6±28.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.6 mmHg at 25°C
Enthalpy of Vaporization: 81.2±6.0 kJ/mol
Flash Point: 184.6±12.5 °C
Index of Refraction: 1.481
Molar Refractivity: 92.9±0.3 cm3
#H bond acceptors: 5
#H bond donors: 1
#Freely Rotating Bonds: 16
#Rule of 5 Violations: 1
ACD/LogP: 6.75
ACD/LogD (pH 5.5): 5.51
ACD/BCF (pH 5.5): 5490.98
ACD/KOC (pH 5.5): 9048.24
ACD/LogD (pH 7.4): 3.71
ACD/BCF (pH 7.4): 86.42
ACD/KOC (pH 7.4): 142.41
Polar Surface Area: 83 Å2
Polarizability: 36.8±0.5 10-24cm3
Surface Tension: 38.3±3.0 dyne/cm
Molar Volume: 326.5±3.0 cm3

Click to predict properties on the Chemicalize site


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