ChemSpider 2D Image | (1R,2R,3R,6R,7R,7aR)-1,2,6,7-Tetrahydroxy-3-(hydroxymethyl)hexahydro-1H-pyrrolizinium | C8H16NO5

(1R,2R,3R,6R,7R,7aR)-1,2,6,7-Tetrahydroxy-3-(hydroxymethyl)hexahydro-1H-pyrrolizinium

  • Molecular FormulaC8H16NO5
  • Average mass206.216 Da
  • Monoisotopic mass206.102295 Da
  • ChemSpider ID77421405

  • Charge - Charge

    defined stereocentres - 6 of 6 defined stereocentres

More details:

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

(1R,2R,3R,6R,7R,7aR)-1,2,6,7-Tetrahydroxy-3-(hydroxymethyl)hexahydro-1H-pyrrolizinium [German] [ACD/IUPAC Name]
(1R,2R,3R,6R,7R,7aR)-1,2,6,7-Tetrahydroxy-3-(hydroxymethyl)hexahydro-1H-pyrrolizinium [ACD/IUPAC Name]
(1R,2R,3R,6R,7R,7aR)-1,2,6,7-Tétrahydroxy-3-(hydroxyméthyl)hexahydro-1H-pyrrolizinium [French] [ACD/IUPAC Name]
1H-Pyrrolizinium, hexahydro-1,2,6,7-tetrahydroxy-3-(hydroxymethyl)-, (1R,2R,3R,6R,7R,7aR)- [ACD/Index Name]

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

Density:
Boiling Point: 448.5±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.5 mmHg at 25°C
Enthalpy of Vaporization: 81.6±6.0 kJ/mol
Flash Point: 287.4±27.4 °C
Index of Refraction:
Molar Refractivity:
#H bond acceptors: 6
#H bond donors: 5
#Freely Rotating Bonds: 1
#Rule of 5 Violations: 1
ACD/LogP: -1.51
ACD/LogD (pH 5.5): -2.98
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -1.79
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 2.31
Polar Surface Area: 106 Å2
Polarizability:
Surface Tension:
Molar Volume:

Click to predict properties on the Chemicalize site


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