Found 18 results

Search term: MF = 'C_{28}H_{38}O_{14}'
ChemSpider 2D Image | 4-[(1R,2R)-1,3-Dihydroxy-2-{4-[(1E)-3-hydroxy-1-propen-1-yl]-2,6-dimethoxyphenoxy}propyl]-2,6-dimethoxyphenyl beta-D-glucopyranoside | C28H38O14

4-[(1R,2R)-1,3-Dihydroxy-2-{4-[(1E)-3-hydroxy-1-propen-1-yl]-2,6-dimethoxyphenoxy}propyl]-2,6-dimethoxyphenyl β-D-glucopyranoside

  • Molecular FormulaC28H38O14
  • Average mass598.593 Da
  • Monoisotopic mass598.226135 Da
  • ChemSpider ID8252810

  • Double-bond stereo - Double-bond stereo

    defined stereocentres - 7 of 7 defined stereocentres

More details:

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

4-[(1R,2R)-1,3-Dihydroxy-2-{4-[(1E)-3-hydroxy-1-propen-1-yl]-2,6-dimethoxyphenoxy}propyl]-2,6-dimethoxyphenyl β-D-glucopyranoside [ACD/IUPAC Name]
4-[(1R,2R)-1,3-Dihydroxy-2-{4-[(1E)-3-hydroxy-1-propen-1-yl]-2,6-dimethoxyphenoxy}propyl]-2,6-dimethoxyphenyl-β-D-glucopyranosid [German] [ACD/IUPAC Name]
β-D-Glucopyranoside de 4-[(1R,2R)-1,3-dihydroxy-2-{4-[(1E)-3-hydroxy-1-propén-1-yl]-2,6-diméthoxyphénoxy}propyl]-2,6-diméthoxyphényle [French] [ACD/IUPAC Name]
β-D-Glucopyranoside, 4-[(1R,2R)-1,3-dihydroxy-2-[4-[(1E)-3-hydroxy-1-propen-1-yl]-2,6-dimethoxyphenoxy]propyl]-2,6-dimethoxyphenyl [ACD/Index Name]

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

Density: 1.4±0.1 g/cm3
Boiling Point: 887.9±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.3 mmHg at 25°C
Enthalpy of Vaporization: 135.2±3.0 kJ/mol
Flash Point: 490.8±34.3 °C
Index of Refraction: 1.622
Molar Refractivity: 149.6±0.3 cm3
#H bond acceptors: 14
#H bond donors: 7
#Freely Rotating Bonds: 14
#Rule of 5 Violations: 3
ACD/LogP: -2.31
ACD/LogD (pH 5.5): -1.54
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 3.47
ACD/LogD (pH 7.4): -1.54
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 3.47
Polar Surface Area: 206 Å2
Polarizability: 59.3±0.5 10-24cm3
Surface Tension: 59.8±3.0 dyne/cm
Molar Volume: 424.9±3.0 cm3

Click to predict properties on the Chemicalize site


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