ChemSpider 2D Image | (2R,3R,4R,5S)-3,4-Dihydroxy-2-(hydroxymethyl)-5-phenylpyrrolidinium | C11H16NO3

(2R,3R,4R,5S)-3,4-Dihydroxy-2-(hydroxymethyl)-5-phenylpyrrolidinium

  • Molecular FormulaC11H16NO3
  • Average mass210.249 Da
  • Monoisotopic mass210.112473 Da
  • ChemSpider ID77411130

  • Charge - Charge

    defined stereocentres - 4 of 4 defined stereocentres

More details:

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

(2R,3R,4R,5S)-3,4-Dihydroxy-2-(hydroxymethyl)-5-phenylpyrrolidinium [German] [ACD/IUPAC Name]
(2R,3R,4R,5S)-3,4-Dihydroxy-2-(hydroxymethyl)-5-phenylpyrrolidinium [ACD/IUPAC Name]
(2R,3R,4R,5S)-3,4-Dihydroxy-2-(hydroxyméthyl)-5-phénylpyrrolidinium [French] [ACD/IUPAC Name]
3,4-Pyrrolidinediol, 2-(hydroxymethyl)-5-phenyl-, conjugate acid, (2R,3R,4R,5S)- [ACD/Index Name]

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

Density:
Boiling Point: 416.4±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.0 mmHg at 25°C
Enthalpy of Vaporization: 70.6±3.0 kJ/mol
Flash Point: 191.0±19.3 °C
Index of Refraction:
Molar Refractivity:
#H bond acceptors: 4
#H bond donors: 4
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 0
ACD/LogP: -0.54
ACD/LogD (pH 5.5): -2.87
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -1.27
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.37
Polar Surface Area: 77 Å2
Polarizability:
Surface Tension:
Molar Volume:

Click to predict properties on the Chemicalize site


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