ChemSpider 2D Image | 2-Propyl(4,4,5,5,5-~2~H_5_)pentanoic acid | C8H11D5O2

2-Propyl(4,4,5,5,5-2H5)pentanoic acid

  • Molecular FormulaC8H11D5O2
  • Average mass149.242 Da
  • Monoisotopic mass149.146408 Da
  • ChemSpider ID68895797

  • Non-standard isotope - Non-standard isotope

More details:

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

2-Propyl(4,4,5,5,5-2H5)pentanoic acid [ACD/IUPAC Name]
2-Propyl(4,4,5,5,5-2H5)pentansäure [German] [ACD/IUPAC Name]
Acide 2-propyl(4,4,5,5,5-2H5)pentanoïque [French] [ACD/IUPAC Name]
Pentanoic-4,4,5,5,5-d5 acid, 2-propyl- [ACD/Index Name]

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

Density: 0.9±0.1 g/cm3
Boiling Point: 220.0±0.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.9 mmHg at 25°C
Enthalpy of Vaporization: 50.3±6.0 kJ/mol
Flash Point: 111.1±0.0 °C
Index of Refraction: 1.435
Molar Refractivity: 40.6±0.3 cm3
#H bond acceptors: 2
#H bond donors: 1
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 0
ACD/LogP: 2.72
ACD/LogD (pH 5.5): 1.89
ACD/BCF (pH 5.5): 10.52
ACD/KOC (pH 5.5): 113.71
ACD/LogD (pH 7.4): 0.10
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.84
Polar Surface Area: 37 Å2
Polarizability: 16.1±0.5 10-24cm3
Surface Tension: 31.8±3.0 dyne/cm
Molar Volume: 155.6±3.0 cm3

Click to predict properties on the Chemicalize site


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