ChemSpider 2D Image | 1-Phenyl-3-(~2~H_5_)azetidinol | C9H6D5NO

1-Phenyl-3-(2H5)azetidinol

  • Molecular FormulaC9H6D5NO
  • Average mass154.221 Da
  • Monoisotopic mass154.115448 Da
  • ChemSpider ID111332350

  • Non-standard isotope - Non-standard isotope

More details:

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

1-Phenyl-3-(2H5)azetidinol [German] [ACD/IUPAC Name]
1-Phenyl-3-(2H5)azetidinol [ACD/IUPAC Name]
1-Phényl-3-(2H5)azétidinol [French] [ACD/IUPAC Name]
3-Azetidin-2,2,3,4,4-d5-ol, 1-phenyl- [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: 281.4±33.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.6 mmHg at 25°C
Enthalpy of Vaporization: 54.9±3.0 kJ/mol
Flash Point: 152.7±24.0 °C
Index of Refraction: 1.623
Molar Refractivity: 43.4±0.3 cm3
#H bond acceptors: 2
#H bond donors: 1
#Freely Rotating Bonds: 1
#Rule of 5 Violations: 0
ACD/LogP: 0.41
ACD/LogD (pH 5.5): 0.42
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 22.84
ACD/LogD (pH 7.4): 0.94
ACD/BCF (pH 7.4): 3.03
ACD/KOC (pH 7.4): 76.24
Polar Surface Area: 23 Å2
Polarizability: 17.2±0.5 10-24cm3
Surface Tension: 55.1±3.0 dyne/cm
Molar Volume: 123.2±3.0 cm3

Click to predict properties on the Chemicalize site


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