ChemSpider 2D Image | 2-(~2~H_5_)Ethylpentanoic acid | C7H9D5O2

2-(2H5)Ethylpentanoic acid

  • Molecular FormulaC7H9D5O2
  • Average mass135.216 Da
  • Monoisotopic mass135.130768 Da
  • ChemSpider ID58783323
  • Non-standard isotope - Non-standard isotope


More details:






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

2-(2H5)Ethylpentanoic acid [ACD/IUPAC Name]
2-(2H5)Ethylpentansäure [German] [ACD/IUPAC Name]
Acide 2-(2H5)éthylpentanoïque [French] [ACD/IUPAC Name]
Pentanoic acid, 2-(ethyl-d5)- [ACD/Index Name]

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module

Density: 0.9±0.1 g/cm3
Boiling Point: 209.2±0.0 °C at 760 mmHg
Vapour Pressure: 0.1±0.8 mmHg at 25°C
Enthalpy of Vaporization: 49.1±6.0 kJ/mol
Flash Point: 102.8±6.9 °C
Index of Refraction: 1.431
Molar Refractivity: 36.0±0.3 cm3
#H bond acceptors: 2
#H bond donors: 1
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: 2.19
ACD/LogD (pH 5.5): 1.38
ACD/BCF (pH 5.5): 4.28
ACD/KOC (pH 5.5): 59.77
ACD/LogD (pH 7.4): -0.42
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 37 Å2
Polarizability: 14.3±0.5 10-24cm3
Surface Tension: 31.6±3.0 dyne/cm
Molar Volume: 139.1±3.0 cm3

Click to predict properties on the Chemicalize site






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