ChemSpider 2D Image | Oxo[(~2~H_5_)phenyl]acetic acid | C8HD5O3

Oxo[(2H5)phenyl]acetic acid

  • Molecular FormulaC8HD5O3
  • Average mass155.162 Da
  • Monoisotopic mass155.063080 Da
  • ChemSpider ID48060787

  • Non-standard isotope - Non-standard isotope

More details:

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

Acide oxo[(2H5)phényl]acétique [French] [ACD/IUPAC Name]
Benzene-2,3,4,5,6-d5-acetic acid, α-oxo- [ACD/Index Name]
Oxo[(2H5)phenyl]acetic acid [ACD/IUPAC Name]
Oxo[(2H5)phenyl]essigsäure [German] [ACD/IUPAC Name]
1217089-53-6 [RN]
2-oxo-2-(2,3,4,5,6-pentadeuteriophenyl)acetic acid

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

Density: 1.3±0.1 g/cm3
Boiling Point: 258.6±13.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.6 mmHg at 25°C
Enthalpy of Vaporization: 52.4±3.0 kJ/mol
Flash Point: 124.4±16.3 °C
Index of Refraction: 1.569
Molar Refractivity: 37.8±0.3 cm3
#H bond acceptors: 3
#H bond donors: 1
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 0
ACD/LogP: 0.69
ACD/LogD (pH 5.5): -2.38
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -2.91
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 54 Å2
Polarizability: 15.0±0.5 10-24cm3
Surface Tension: 54.6±3.0 dyne/cm
Molar Volume: 115.6±3.0 cm3

Click to predict properties on the Chemicalize site


Advertisement