ChemSpider 2D Image | Ethyl 3-hydroxy-4-methyl-2,2-bis[(~2~H_3_)methyl]pentanoate | C10H14D6O3

Ethyl 3-hydroxy-4-methyl-2,2-bis[(2H3)methyl]pentanoate

  • Molecular FormulaC10H14D6O3
  • Average mass194.301 Da
  • Monoisotopic mass194.178909 Da
  • ChemSpider ID58782710

  • Non-standard isotope - Non-standard isotope

More details:

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

3-Hydroxy-4-méthyl-2,2-bis[(2H3)méthyl]pentanoate d'éthyle [French] [ACD/IUPAC Name]
Ethyl 3-hydroxy-4-methyl-2,2-bis[(2H3)methyl]pentanoate [ACD/IUPAC Name]
Ethyl-3-hydroxy-4-methyl-2,2-bis[(2H3)methyl]pentanoat [German] [ACD/IUPAC Name]
Pentanoic acid, 3-hydroxy-4-methyl-2,2-di(methyl-d3)-, ethyl ester [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: 259.8±13.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.2 mmHg at 25°C
Enthalpy of Vaporization: 57.8±6.0 kJ/mol
Flash Point: 98.4±12.6 °C
Index of Refraction: 1.441
Molar Refractivity: 51.6±0.3 cm3
#H bond acceptors: 3
#H bond donors: 1
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 0
ACD/LogP: 1.56
ACD/LogD (pH 5.5): 1.88
ACD/BCF (pH 5.5): 15.66
ACD/KOC (pH 5.5): 249.41
ACD/LogD (pH 7.4): 1.88
ACD/BCF (pH 7.4): 15.66
ACD/KOC (pH 7.4): 249.41
Polar Surface Area: 47 Å2
Polarizability: 20.4±0.5 10-24cm3
Surface Tension: 31.1±3.0 dyne/cm
Molar Volume: 195.4±3.0 cm3

Click to predict properties on the Chemicalize site


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