ChemSpider 2D Image | 2-(2-{2-[(~2~H_3_)Methyloxy]phenoxy}ethyl)-1H-isoindole-1,3(2H)-dione | C17H12D3NO4

2-(2-{2-[(2H3)Methyloxy]phenoxy}ethyl)-1H-isoindole-1,3(2H)-dione

  • Molecular FormulaC17H12D3NO4
  • Average mass300.324 Da
  • Monoisotopic mass300.118927 Da
  • ChemSpider ID107434600

  • 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-[2-[2-(methyl-d3-oxy)phenoxy]ethyl]- [ACD/Index Name]
2-(2-{2-[(2H3)Methyloxy]phenoxy}ethyl)-1H-isoindol-1,3(2H)-dion [German] [ACD/IUPAC Name]
2-(2-{2-[(2H3)Methyloxy]phenoxy}ethyl)-1H-isoindole-1,3(2H)-dione [ACD/IUPAC Name]
2-(2-{2-[(2H3)Méthyloxy]phénoxy}éthyl)-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: 449.5±25.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.1 mmHg at 25°C
Enthalpy of Vaporization: 70.8±3.0 kJ/mol
Flash Point: 225.7±23.2 °C
Index of Refraction: 1.603
Molar Refractivity: 79.9±0.3 cm3
#H bond acceptors: 5
#H bond donors: 0
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 0
ACD/LogP: 3.30
ACD/LogD (pH 5.5): 2.85
ACD/BCF (pH 5.5): 86.31
ACD/KOC (pH 5.5): 846.12
ACD/LogD (pH 7.4): 2.85
ACD/BCF (pH 7.4): 86.31
ACD/KOC (pH 7.4): 846.12
Polar Surface Area: 56 Å2
Polarizability: 31.7±0.5 10-24cm3
Surface Tension: 51.2±3.0 dyne/cm
Molar Volume: 232.6±3.0 cm3

Click to predict properties on the Chemicalize site


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