ChemSpider 2D Image | (1,2,4-~2~H_3_)Benzene | C6H3D3

(1,2,4-2H3)Benzene

  • Molecular FormulaC6H3D3
  • Average mass81.130 Da
  • Monoisotopic mass81.065781 Da
  • ChemSpider ID25196671
  • Non-standard isotope - Non-standard isotope


More details:






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

(1,2,4-2H3)Benzene [ACD/IUPAC Name]
(1,2,4-2H3)Benzène [French] [ACD/IUPAC Name]
(1,2,4-2H3)Benzol [German] [ACD/IUPAC Name]
Benzene-1,2,4-d3 [ACD/Index Name]
14941-53-8 [RN]
Benzene-1,2,4-d3

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

Density: 0.9±0.1 g/cm3
Boiling Point: 78.8±7.0 °C at 760 mmHg
Vapour Pressure: 100.9±0.1 mmHg at 25°C
Enthalpy of Vaporization: 30.7±0.0 kJ/mol
Flash Point: -11.1±0.0 °C
Index of Refraction: 1.499
Molar Refractivity: 26.3±0.3 cm3
#H bond acceptors: 0
#H bond donors: 0
#Freely Rotating Bonds: 0
#Rule of 5 Violations: 0
ACD/LogP: 2.22
ACD/LogD (pH 5.5): 2.04
ACD/BCF (pH 5.5): 20.92
ACD/KOC (pH 5.5): 306.84
ACD/LogD (pH 7.4): 2.04
ACD/BCF (pH 7.4): 20.92
ACD/KOC (pH 7.4): 306.84
Polar Surface Area: 0 Å2
Polarizability: 10.4±0.5 10-24cm3
Surface Tension: 28.9±3.0 dyne/cm
Molar Volume: 89.4±3.0 cm3

Click to predict properties on the Chemicalize site





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