ChemSpider 2D Image | 1,3,5-(2,4-~2~H_2_)Benzene(3-~2~H)triol | C6H3D3O3

1,3,5-(2,4-2H2)Benzene(3-2H)triol

  • Molecular FormulaC6H3D3O3
  • Average mass129.128 Da
  • Monoisotopic mass129.050522 Da
  • ChemSpider ID31047101
  • Non-standard isotope - Non-standard isotope


More details:






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

1,3,5-(2,4-2H2)Benzene(3-2H)triol [ACD/IUPAC Name]
1,3,5-(2,4-2H2)Benzène(3-2H)triol [French] [ACD/IUPAC Name]
1,3,5-(2,4-2H2)Benzol(3-2H)triol [German] [ACD/IUPAC Name]
1,3,5-Benzene-2,4-d2-triol-d [ACD/Index Name]
1036711-64-4 [RN]
Phloroglucinol-d3

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

Density: 1.5±0.1 g/cm3
Boiling Point: 331.1±12.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.7 mmHg at 25°C
Enthalpy of Vaporization: 59.7±3.0 kJ/mol
Flash Point: 174.9±14.2 °C
Index of Refraction: 1.677
Molar Refractivity: 31.9±0.3 cm3
#H bond acceptors: 3
#H bond donors: 3
#Freely Rotating Bonds: 0
#Rule of 5 Violations: 0
ACD/LogP: 0.06
ACD/LogD (pH 5.5): 0.25
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 32.45
ACD/LogD (pH 7.4): 0.24
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 31.77
Polar Surface Area: 61 Å2
Polarizability: 12.6±0.5 10-24cm3
Surface Tension: 78.7±3.0 dyne/cm
Molar Volume: 84.7±3.0 cm3

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