ChemSpider 2D Image | (~2~H_3_)Methyl heptadecanoate | C18H33D3O2

(2H3)Methyl heptadecanoate

  • Molecular FormulaC18H33D3O2
  • Average mass287.496 Da
  • Monoisotopic mass287.290375 Da
  • ChemSpider ID48062631

  • Non-standard isotope - Non-standard isotope

More details:

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

(2H3)Methyl heptadecanoate [ACD/IUPAC Name]
(2H3)Methyl-heptadecanoat [German] [ACD/IUPAC Name]
Heptadécanoate de (2H3)méthyle [French] [ACD/IUPAC Name]
Heptadecanoic acid, methyl-d3 ester [ACD/Index Name]
209627-97-4 [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: 337.1±5.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.7 mmHg at 25°C
Enthalpy of Vaporization: 58.0±3.0 kJ/mol
Flash Point: 161.2±7.5 °C
Index of Refraction: 1.443
Molar Refractivity: 87.2±0.3 cm3
#H bond acceptors: 2
#H bond donors: 0
#Freely Rotating Bonds: 16
#Rule of 5 Violations: 1
ACD/LogP: 8.15
ACD/LogD (pH 5.5): 8.20
ACD/BCF (pH 5.5): 1000000.00
ACD/KOC (pH 5.5): 689572.06
ACD/LogD (pH 7.4): 8.20
ACD/BCF (pH 7.4): 1000000.00
ACD/KOC (pH 7.4): 689572.06
Polar Surface Area: 26 Å2
Polarizability: 34.6±0.5 10-24cm3
Surface Tension: 30.4±3.0 dyne/cm
Molar Volume: 329.1±3.0 cm3

Click to predict properties on the Chemicalize site


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