ChemSpider 2D Image | 2-(~2~H)Hydroxy-5-{1-(~2~H)hydroxy-2-[(4-phenyl-2-butanyl)(~2~H)amino]ethyl}(N,N-~2~H_2_)benzamide | C19H19D5N2O3

2-(2H)Hydroxy-5-{1-(2H)hydroxy-2-[(4-phenyl-2-butanyl)(2H)amino]ethyl}(N,N-2H2)benzamide

  • Molecular FormulaC19H19D5N2O3
  • Average mass333.436 Da
  • Monoisotopic mass333.210083 Da
  • ChemSpider ID95662098

  • Non-standard isotope - Non-standard isotope

More details:

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

2-(2H)Hydroxy-5-{1-(2H)hydroxy-2-[(4-phenyl-2-butanyl)(2H)amino]ethyl}(N,N-2H2)benzamid [German] [ACD/IUPAC Name]
2-(2H)Hydroxy-5-{1-(2H)hydroxy-2-[(4-phenyl-2-butanyl)(2H)amino]ethyl}(N,N-2H2)benzamide [ACD/IUPAC Name]
2-(2H)Hydroxy-5-{1-(2H)hydroxy-2-[(4-phényl-2-butanyl)(2H)amino]éthyl}(N,N-2H2)benzamide [French] [ACD/IUPAC Name]
Benzamide-d2, 2-(hydroxy-d)-5-[1-(hydroxy-d)-2-[(1-methyl-3-phenylpropyl)amino-d]ethyl]- [ACD/Index Name]

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

Density: 1.2±0.1 g/cm3
Boiling Point: 552.7±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.6 mmHg at 25°C
Enthalpy of Vaporization: 87.7±3.0 kJ/mol
Flash Point: 288.1±30.1 °C
Index of Refraction: 1.609
Molar Refractivity: 94.7±0.3 cm3
#H bond acceptors: 5
#H bond donors: 5
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 1
ACD/LogP: 2.31
ACD/LogD (pH 5.5): -0.27
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): 0.85
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 9.43
Polar Surface Area: 96 Å2
Polarizability: 37.6±0.5 10-24cm3
Surface Tension: 55.1±3.0 dyne/cm
Molar Volume: 273.6±3.0 cm3

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