ChemSpider 2D Image | 2-[(~2~H_3_)Methylamino]-1H-isoindole-1,3(2H)-dione | C9H5D3N2O2

2-[(2H3)Methylamino]-1H-isoindole-1,3(2H)-dione

  • Molecular FormulaC9H5D3N2O2
  • Average mass179.191 Da
  • Monoisotopic mass179.077408 Da
  • ChemSpider ID58793851

  • 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-(methyl-d3-amino)- [ACD/Index Name]
2-[(2H3)Methylamino]-1H-isoindol-1,3(2H)-dion [German] [ACD/IUPAC Name]
2-[(2H3)Methylamino]-1H-isoindole-1,3(2H)-dione [ACD/IUPAC Name]
2-[(2H3)Méthylamino]-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: 1.4±0.1 g/cm3
Boiling Point: 313.7±25.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.7 mmHg at 25°C
Enthalpy of Vaporization: 55.5±3.0 kJ/mol
Flash Point: 143.5±23.2 °C
Index of Refraction: 1.639
Molar Refractivity: 46.4±0.4 cm3
#H bond acceptors: 4
#H bond donors: 1
#Freely Rotating Bonds: 1
#Rule of 5 Violations: 0
ACD/LogP: 0.37
ACD/LogD (pH 5.5): 0.94
ACD/BCF (pH 5.5): 3.06
ACD/KOC (pH 5.5): 77.44
ACD/LogD (pH 7.4): 0.94
ACD/BCF (pH 7.4): 3.06
ACD/KOC (pH 7.4): 77.44
Polar Surface Area: 49 Å2
Polarizability: 18.4±0.5 10-24cm3
Surface Tension: 59.3±5.0 dyne/cm
Molar Volume: 128.8±5.0 cm3

Click to predict properties on the Chemicalize site


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