Found 85 results

Search term: MF = 'C_{20}H_{26}O_{10}'
ChemSpider 2D Image | 2-(beta-D-Glucopyranosyloxy)benzyl 1,6-dihydroxy-2-cyclohexene-1-carboxylate | C20H26O10

2-(β-D-Glucopyranosyloxy)benzyl 1,6-dihydroxy-2-cyclohexene-1-carboxylate

  • Molecular FormulaC20H26O10
  • Average mass426.414 Da
  • Monoisotopic mass426.152588 Da
  • ChemSpider ID22943507

  • defined stereocentres - 5 of 7 defined stereocentres

More details:

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

1,6-Dihydroxy-2-cyclohexène-1-carboxylate de 2-(β-D-glucopyranosyloxy)benzyle [French] [ACD/IUPAC Name]
2-(β-D-Glucopyranosyloxy)benzyl 1,6-dihydroxy-2-cyclohexene-1-carboxylate [ACD/IUPAC Name]
2-(β-D-Glucopyranosyloxy)benzyl-1,6-dihydroxy-2-cyclohexen-1-carboxylat [German] [ACD/IUPAC Name]
2-Cyclohexene-1-carboxylic acid, 1,6-dihydroxy-, [2-(β-D-glucopyranosyloxy)phenyl]methyl ester [ACD/Index Name]

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

Density: 1.5±0.1 g/cm3
Boiling Point: 680.0±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.2 mmHg at 25°C
Enthalpy of Vaporization: 104.8±3.0 kJ/mol
Flash Point: 238.8±25.0 °C
Index of Refraction: 1.652
Molar Refractivity: 101.5±0.3 cm3
#H bond acceptors: 10
#H bond donors: 6
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 2
ACD/LogP: -1.21
ACD/LogD (pH 5.5): -1.20
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 5.33
ACD/LogD (pH 7.4): -1.20
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 5.33
Polar Surface Area: 166 Å2
Polarizability: 40.2±0.5 10-24cm3
Surface Tension: 85.4±3.0 dyne/cm
Molar Volume: 277.5±3.0 cm3

Click to predict properties on the Chemicalize site


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