ChemSpider 2D Image | 2-[3-Hydroxy(3,3-~2~H_2_)propyl]-1H-isoindole-1,3(2H)-dione | C11H9D2NO3

2-[3-Hydroxy(3,3-2H2)propyl]-1H-isoindole-1,3(2H)-dione

  • Molecular FormulaC11H9D2NO3
  • Average mass207.222 Da
  • Monoisotopic mass207.086441 Da
  • ChemSpider ID30904157

  • Non-standard isotope - Non-standard isotope

More details:

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

1H-Isoindole-1,3(2H)-dione, 2-(3-hydroxypropyl-3,3-d2)- [ACD/Index Name]
2-[3-Hydroxy(3,3-2H2)propyl]-1H-isoindol-1,3(2H)-dion [German] [ACD/IUPAC Name]
2-[3-Hydroxy(3,3-2H2)propyl]-1H-isoindole-1,3(2H)-dione [ACD/IUPAC Name]
2-[3-Hydroxy(3,3-2H2)propyl]-1H-isoindole-1,3(2H)-dione [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: 376.5±25.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.9 mmHg at 25°C
Enthalpy of Vaporization: 65.8±3.0 kJ/mol
Flash Point: 181.5±23.2 °C
Index of Refraction: 1.606
Molar Refractivity: 53.1±0.3 cm3
#H bond acceptors: 4
#H bond donors: 1
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: 1.14
ACD/LogD (pH 5.5): 1.12
ACD/BCF (pH 5.5): 4.18
ACD/KOC (pH 5.5): 96.96
ACD/LogD (pH 7.4): 1.12
ACD/BCF (pH 7.4): 4.18
ACD/KOC (pH 7.4): 96.96
Polar Surface Area: 58 Å2
Polarizability: 21.1±0.5 10-24cm3
Surface Tension: 58.5±3.0 dyne/cm
Molar Volume: 154.2±3.0 cm3

Click to predict properties on the Chemicalize site


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