ChemSpider 2D Image | OXIRANPSEUDOGLUCOSE | C7H12O5

OXIRANPSEUDOGLUCOSE

  • Molecular FormulaC7H12O5
  • Average mass176.167 Da
  • Monoisotopic mass176.068466 Da
  • ChemSpider ID26329717
  • defined stereocentres - 5 of 5 defined stereocentres


More details:






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

(1R,2R,3R,4S,6S)-1-(Hydroxymethyl)-7-oxabicyclo[4.1.0]heptan-2,3,4-triol [German] [ACD/IUPAC Name]
(1R,2R,3R,4S,6S)-1-(Hydroxymethyl)-7-oxabicyclo[4.1.0]heptane-2,3,4-triol [ACD/IUPAC Name]
(1R,2R,3R,4S,6S)-1-(Hydroxyméthyl)-7-oxabicyclo[4.1.0]heptane-2,3,4-triol [French] [ACD/IUPAC Name]
7-Oxabicyclo[4.1.0]heptane-2,3,4-triol, 1-(hydroxymethyl)-, (1R,2R,3R,4S,6S)- [ACD/Index Name]
OXIRANPSEUDOGLUCOSE

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module

Density: 1.8±0.1 g/cm3
Boiling Point: 379.3±42.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.9 mmHg at 25°C
Enthalpy of Vaporization: 72.6±6.0 kJ/mol
Flash Point: 183.2±27.9 °C
Index of Refraction: 1.685
Molar Refractivity: 38.2±0.3 cm3
#H bond acceptors: 5
#H bond donors: 4
#Freely Rotating Bonds: 1
#Rule of 5 Violations: 0
ACD/LogP: -0.94
ACD/LogD (pH 5.5): -1.24
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 5.05
ACD/LogD (pH 7.4): -1.24
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 5.05
Polar Surface Area: 93 Å2
Polarizability: 15.2±0.5 10-24cm3
Surface Tension: 99.9±3.0 dyne/cm
Molar Volume: 100.5±3.0 cm3

Click to predict properties on the Chemicalize site






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