ChemSpider 2D Image | 1,2-Benzene(~2~H_2_)dicarboxylic acid | C8H4D2O4

1,2-Benzene(2H2)dicarboxylic acid

  • Molecular FormulaC8H4D2O4
  • Average mass168.143 Da
  • Monoisotopic mass168.039169 Da
  • ChemSpider ID62901097
  • Non-standard isotope - Non-standard isotope


More details:






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

1,2-Benzene(2H2)dicarboxylic acid [ACD/IUPAC Name]
1,2-Benzenedicarboxylic acid-d2 [ACD/Index Name]
1,2-Benzol(2H2)dicarbonsäure [German] [ACD/IUPAC Name]
Acide 1,2-benzène(2H2)dicarboxylique [French] [ACD/IUPAC Name]
4123-68-6 [RN]

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

Density: 1.5±0.1 g/cm3
Boiling Point: 378.3±25.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.9 mmHg at 25°C
Enthalpy of Vaporization: 66.1±3.0 kJ/mol
Flash Point: 196.7±19.7 °C
Index of Refraction: 1.618
Molar Refractivity: 40.1±0.3 cm3
#H bond acceptors: 4
#H bond donors: 2
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 0
ACD/LogP: 0.81
ACD/LogD (pH 5.5): -1.46
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -2.78
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 75 Å2
Polarizability: 15.9±0.5 10-24cm3
Surface Tension: 70.3±3.0 dyne/cm
Molar Volume: 114.5±3.0 cm3

Click to predict properties on the Chemicalize site






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