ChemSpider 2D Image | (6S)-2,6-Anhydro-6-(5-methyl-1,3,4-oxadiazol-2-yl)-D-galactitol | C9H14N2O6

(6S)-2,6-Anhydro-6-(5-methyl-1,3,4-oxadiazol-2-yl)-D-galactitol

  • Molecular FormulaC9H14N2O6
  • Average mass246.217 Da
  • Monoisotopic mass246.085190 Da
  • ChemSpider ID62479083
  • defined stereocentres - 5 of 5 defined stereocentres


More details:






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

(6S)-2,6-Anhydro-6-(5-methyl-1,3,4-oxadiazol-2-yl)-D-galactitol [German] [ACD/IUPAC Name]
(6S)-2,6-Anhydro-6-(5-methyl-1,3,4-oxadiazol-2-yl)-D-galactitol [ACD/IUPAC Name]
(6S)-2,6-Anhydro-6-(5-méthyl-1,3,4-oxadiazol-2-yl)-D-galactitol [French] [ACD/IUPAC Name]
D-Galactitol, 2,6-anhydro-6-C-(5-methyl-1,3,4-oxadiazol-2-yl)-, (6S)- [ACD/Index Name]

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

Density: 1.6±0.1 g/cm3
Boiling Point: 524.4±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.4 mmHg at 25°C
Enthalpy of Vaporization: 84.0±3.0 kJ/mol
Flash Point: 270.9±32.9 °C
Index of Refraction: 1.597
Molar Refractivity: 53.4±0.3 cm3
#H bond acceptors: 8
#H bond donors: 4
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 0
ACD/LogP: -0.83
ACD/LogD (pH 5.5): -1.11
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 5.94
ACD/LogD (pH 7.4): -1.11
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 5.94
Polar Surface Area: 129 Å2
Polarizability: 21.2±0.5 10-24cm3
Surface Tension: 73.8±3.0 dyne/cm
Molar Volume: 156.7±3.0 cm3

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