ChemSpider 2D Image | 7-Hydroxy-2-(3,4,5,6,8-~2~H_5_)chromanone | C9H3D5O3

7-Hydroxy-2-(3,4,5,6,8-2H5)chromanone

  • Molecular FormulaC9H3D5O3
  • Average mass169.189 Da
  • Monoisotopic mass169.078735 Da
  • ChemSpider ID111089253

  • Non-standard isotope - Non-standard isotope

More details:

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

2H-1-Benzopyran-2-one-3,4,5,6,8-d5, 3,4-dihydro-7-hydroxy- [ACD/Index Name]
7-Hydroxy-2-(3,4,5,6,8-2H5)chromanon [German] [ACD/IUPAC Name]
7-Hydroxy-2-(3,4,5,6,8-2H5)chromanone [ACD/IUPAC Name]
7-Hydroxy-2-(3,4,5,6,8-2H5)chromanone [French] [ACD/IUPAC Name]

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

Density: 1.3±0.1 g/cm3
Boiling Point: 356.1±31.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.8 mmHg at 25°C
Enthalpy of Vaporization: 62.5±3.0 kJ/mol
Flash Point: 166.0±17.6 °C
Index of Refraction: 1.604
Molar Refractivity: 42.0±0.3 cm3
#H bond acceptors: 3
#H bond donors: 1
#Freely Rotating Bonds: 0
#Rule of 5 Violations: 0
ACD/LogP: 1.48
ACD/LogD (pH 5.5): 1.23
ACD/BCF (pH 5.5): 5.03
ACD/KOC (pH 5.5): 110.54
ACD/LogD (pH 7.4): 1.22
ACD/BCF (pH 7.4): 4.94
ACD/KOC (pH 7.4): 108.69
Polar Surface Area: 47 Å2
Polarizability: 16.7±0.5 10-24cm3
Surface Tension: 55.3±3.0 dyne/cm
Molar Volume: 122.2±3.0 cm3

Click to predict properties on the Chemicalize site


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