Found 1 result

Search term: AWNGSFAGXKOIML (Found by InChIKey (skeleton match))
ChemSpider 2D Image | 1-Beta-D-Glucopyranosyl-1,3,5-Triazinane-2,4,6-Trione | C9H13N3O8

1-β-D-Glucopyranosyl-1,3,5-Triazinane-2,4,6-Trione

  • Molecular FormulaC9H13N3O8
  • Average mass291.215 Da
  • Monoisotopic mass291.070251 Da
  • ChemSpider ID25057978

  • defined stereocentres - 5 of 5 defined stereocentres

More details:

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

1-(β-D-Glucopyranosyl)-1,3,5-triazinan-2,4,6-trion [German] [ACD/IUPAC Name]
1-(β-D-Glucopyranosyl)-1,3,5-triazinane-2,4,6-trione [ACD/IUPAC Name]
1-(β-D-Glucopyranosyl)-1,3,5-triazinane-2,4,6-trione [French] [ACD/IUPAC Name]
1,3,5-Triazine-2,4,6(1H,3H,5H)-trione, 1-β-D-glucopyranosyl- [ACD/Index Name]
1-β-D-Glucopyranosyl-1,3,5-Triazinane-2,4,6-Trione
C4B

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

Density: 1.8±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.649
Molar Refractivity: 58.2±0.3 cm3
#H bond acceptors: 11
#H bond donors: 6
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 2
ACD/LogP: -3.05
ACD/LogD (pH 5.5): -2.96
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -4.30
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 169 Å2
Polarizability: 23.1±0.5 10-24cm3
Surface Tension: 102.2±3.0 dyne/cm
Molar Volume: 159.8±3.0 cm3

Click to predict properties on the Chemicalize site


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