ChemSpider 2D Image | 1-(4-Aminophenyl)-1-deoxy-D-ribitol | C11H17NO4

1-(4-Aminophenyl)-1-deoxy-D-ribitol

  • Molecular FormulaC11H17NO4
  • Average mass227.257 Da
  • Monoisotopic mass227.115753 Da
  • ChemSpider ID75254418

  • defined stereocentres - 3 of 3 defined stereocentres

More details:

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

1-(4-Aminophenyl)-1-deoxy-D-ribitol [ACD/IUPAC Name]
1-(4-Aminophenyl)-1-desoxy-D-ribitol [German] [ACD/IUPAC Name]
1-(4-Aminophényl)-1-désoxy-D-ribitol [French] [ACD/IUPAC Name]
D-Ribitol, 1-(4-aminophenyl)-1-deoxy- [ACD/Index Name]

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

Density: 1.4±0.1 g/cm3
Boiling Point: 538.1±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.5 mmHg at 25°C
Enthalpy of Vaporization: 85.8±3.0 kJ/mol
Flash Point: 279.2±30.1 °C
Index of Refraction: 1.646
Molar Refractivity: 60.0±0.3 cm3
#H bond acceptors: 5
#H bond donors: 6
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 1
ACD/LogP: -2.10
ACD/LogD (pH 5.5): -1.40
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 3.87
ACD/LogD (pH 7.4): -1.34
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 4.47
Polar Surface Area: 107 Å2
Polarizability: 23.8±0.5 10-24cm3
Surface Tension: 76.2±3.0 dyne/cm
Molar Volume: 165.2±3.0 cm3

Click to predict properties on the Chemicalize site


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