ChemSpider 2D Image | 5-(~2~H_2_)Amino-2-(~2~H)hydroxy(O-~2~H)benzoic acid | C7H3D4NO3

5-(2H2)Amino-2-(2H)hydroxy(O-2H)benzoic acid

  • Molecular FormulaC7H3D4NO3
  • Average mass157.160 Da
  • Monoisotopic mass157.067703 Da
  • ChemSpider ID95625419
  • Non-standard isotope - Non-standard isotope


More details:






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

5-(2H2)Amino-2-(2H)hydroxy(O-2H)benzoesäure [German] [ACD/IUPAC Name]
5-(2H2)Amino-2-(2H)hydroxy(O-2H)benzoic acid [ACD/IUPAC Name]
Acide 5-(2H2)amino-2-(2H)hydroxy(O-2H)benzoïque [French] [ACD/IUPAC Name]
Benzoic acid-d, 5-(amino-d2)-2-(hydroxy-d)- [ACD/Index Name]

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

Density: 1.5±0.1 g/cm3
Boiling Point: 403.9±40.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.0 mmHg at 25°C
Enthalpy of Vaporization: 69.1±3.0 kJ/mol
Flash Point: 198.1±27.3 °C
Index of Refraction: 1.691
Molar Refractivity: 39.3±0.3 cm3
#H bond acceptors: 4
#H bond donors: 4
#Freely Rotating Bonds: 1
#Rule of 5 Violations: 0
ACD/LogP: 0.46
ACD/LogD (pH 5.5): -1.48
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -1.98
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 84 Å2
Polarizability: 15.6±0.5 10-24cm3
Surface Tension: 83.4±3.0 dyne/cm
Molar Volume: 102.7±3.0 cm3

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