Found 2 results

Search term: RFWOWHQEXKRYHZ (Found by InChIKey (skeleton match))
ChemSpider 2D Image | (1R,6S,7R)-3-(Acetoxymethyl)hexahydro-1H-pyrrolizine-1,2,6,7-tetrayl tetraacetate | C18H25NO10

(1R,6S,7R)-3-(Acetoxymethyl)hexahydro-1H-pyrrolizine-1,2,6,7-tetrayl tetraacetate

  • Molecular FormulaC18H25NO10
  • Average mass415.392 Da
  • Monoisotopic mass415.147858 Da
  • ChemSpider ID30650625

  • defined stereocentres - 3 of 6 defined stereocentres

More details:

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

(1R,6S,7R)-3-(Acetoxymethyl)hexahydro-1H-pyrrolizin-1,2,6,7-tetrayl-tetraacetat [German] [ACD/IUPAC Name]
(1R,6S,7R)-3-(Acetoxymethyl)hexahydro-1H-pyrrolizine-1,2,6,7-tetrayl tetraacetate [ACD/IUPAC Name]
1H-Pyrrolizine-1,2,6,7-tetrol, 3-[(acetyloxy)methyl]hexahydro-, tetraacetate (ester), (1R,6S,7R)- [ACD/Index Name]
Tetraacétate de (1R,6S,7R)-3-(acétoxyméthyl)hexahydro-1H-pyrrolizine-1,2,6,7-tétrayle [French] [ACD/IUPAC Name]

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

Density: 1.3±0.1 g/cm3
Boiling Point: 465.5±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.1 mmHg at 25°C
Enthalpy of Vaporization: 72.7±3.0 kJ/mol
Flash Point: 235.3±28.7 °C
Index of Refraction: 1.516
Molar Refractivity: 94.3±0.4 cm3
#H bond acceptors: 11
#H bond donors: 0
#Freely Rotating Bonds: 11
#Rule of 5 Violations: 1
ACD/LogP: -0.51
ACD/LogD (pH 5.5): 0.43
ACD/BCF (pH 5.5): 1.24
ACD/KOC (pH 5.5): 40.48
ACD/LogD (pH 7.4): 0.43
ACD/BCF (pH 7.4): 1.25
ACD/KOC (pH 7.4): 40.73
Polar Surface Area: 135 Å2
Polarizability: 37.4±0.5 10-24cm3
Surface Tension: 50.7±5.0 dyne/cm
Molar Volume: 312.4±5.0 cm3

Click to predict properties on the Chemicalize site


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