ChemSpider 2D Image | 3,4-Dihydroxy(~2~H_3_)benzaldehyde | C7H3D3O3

3,4-Dihydroxy(2H3)benzaldehyde

  • Molecular FormulaC7H3D3O3
  • Average mass141.139 Da
  • Monoisotopic mass141.050522 Da
  • ChemSpider ID62775495
  • Non-standard isotope - Non-standard isotope


More details:






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

3,4-Dihydroxy(2H3)benzaldehyd [German] [ACD/IUPAC Name]
3,4-Dihydroxy(2H3)benzaldehyde [ACD/IUPAC Name]
3,4-Dihydroxy(2H3)benzaldéhyde [French] [ACD/IUPAC Name]
Benzaldehyde-2,3,6-d3, 4,5-dihydroxy- [ACD/Index Name]
180028-20-0 [RN]

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module

Density: 1.4±0.1 g/cm3
Boiling Point: 295.4±20.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.6 mmHg at 25°C
Enthalpy of Vaporization: 55.7±3.0 kJ/mol
Flash Point: 146.7±18.3 °C
Index of Refraction: 1.674
Molar Refractivity: 36.8±0.3 cm3
#H bond acceptors: 3
#H bond donors: 2
#Freely Rotating Bonds: 1
#Rule of 5 Violations: 0
ACD/LogP: 1.14
ACD/LogD (pH 5.5): 1.07
ACD/BCF (pH 5.5): 3.80
ACD/KOC (pH 5.5): 90.33
ACD/LogD (pH 7.4): 0.86
ACD/BCF (pH 7.4): 2.34
ACD/KOC (pH 7.4): 55.61
Polar Surface Area: 58 Å2
Polarizability: 14.6±0.5 10-24cm3
Surface Tension: 69.0±3.0 dyne/cm
Molar Volume: 98.0±3.0 cm3

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