ChemSpider 2D Image | Benzyl D-Glucuronate | C13H16O7

Benzyl D-Glucuronate

  • Molecular FormulaC13H16O7
  • Average mass284.262 Da
  • Monoisotopic mass284.089600 Da
  • ChemSpider ID35466820

  • defined stereocentres - 4 of 4 defined stereocentres

More details:

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

Benzyl D-Glucuronate [ACD/IUPAC Name]
Benzyl-D-glucuronat [German] [ACD/IUPAC Name]
D-Glucuronate de benzyle [French] [ACD/IUPAC Name]
D-Glucuronic acid, phenylmethyl ester [ACD/Index Name]
(2S,3S,4S,5R)-Benzyl 2,3,4,5-tetrahydroxy-6-oxohexanoate
135970-30-8 [RN]

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

Density: 1.4±0.1 g/cm3
Boiling Point: 566.5±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.6 mmHg at 25°C
Enthalpy of Vaporization: 89.5±3.0 kJ/mol
Flash Point: 216.7±23.6 °C
Index of Refraction: 1.594
Molar Refractivity: 66.9±0.3 cm3
#H bond acceptors: 7
#H bond donors: 4
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 0
ACD/LogP: 0.64
ACD/LogD (pH 5.5): -0.13
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 20.29
ACD/LogD (pH 7.4): -0.13
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 20.29
Polar Surface Area: 124 Å2
Polarizability: 26.5±0.5 10-24cm3
Surface Tension: 71.3±3.0 dyne/cm
Molar Volume: 197.1±3.0 cm3

Click to predict properties on the Chemicalize site


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