ChemSpider 2D Image | (2,2,3,3,4,4,5-~2~H_7_)Octadecanoic acid | C18H29D7O2

(2,2,3,3,4,4,5-2H7)Octadecanoic acid

  • Molecular FormulaC18H29D7O2
  • Average mass291.520 Da
  • Monoisotopic mass291.315460 Da
  • ChemSpider ID34998279

  • Non-standard isotope - Non-standard isotope

More details:

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

(2,2,3,3,4,4,5-2H7)Octadecanoic acid [ACD/IUPAC Name]
(2,2,3,3,4,4,5-2H7)Octadecansäure [German] [ACD/IUPAC Name]
Acide (2,2,3,3,4,4,5-2H7)octadécanoïque [French] [ACD/IUPAC Name]
Octadecanoic-2,2,3,3,4,4,5-d7 acid [ACD/Index Name]
951209-59-9 [RN]
Octadecanoic-16,16,17,17,18,18,18-d7Acid

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

Density: 0.9±0.1 g/cm3
Boiling Point: 359.4±5.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.8 mmHg at 25°C
Enthalpy of Vaporization: 63.8±3.0 kJ/mol
Flash Point: 162.4±12.5 °C
Index of Refraction: 1.456
Molar Refractivity: 87.0±0.3 cm3
#H bond acceptors: 2
#H bond donors: 1
#Freely Rotating Bonds: 16
#Rule of 5 Violations: 1
ACD/LogP: 8.22
ACD/LogD (pH 5.5): 7.26
ACD/BCF (pH 5.5): 125575.00
ACD/KOC (pH 5.5): 92278.95
ACD/LogD (pH 7.4): 5.47
ACD/BCF (pH 7.4): 2014.54
ACD/KOC (pH 7.4): 1480.39
Polar Surface Area: 37 Å2
Polarizability: 34.5±0.5 10-24cm3
Surface Tension: 33.4±3.0 dyne/cm
Molar Volume: 320.3±3.0 cm3

Click to predict properties on the Chemicalize site


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