ChemSpider 2D Image | sinapaldehyde glucoside | C17H22O9

sinapaldehyde glucoside

  • Molecular FormulaC17H22O9
  • Average mass370.351 Da
  • Monoisotopic mass370.126373 Da
  • ChemSpider ID29365072

  • Double-bond stereo - Double-bond stereo

    defined stereocentres - 4 of 5 defined stereocentres

More details:

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

154461-65-1 [RN]
2,6-Dimethoxy-4-[(1E)-3-oxo-1-propen-1-yl]phenyl D-glucopyranoside [ACD/IUPAC Name]
2,6-Dimethoxy-4-[(1E)-3-oxo-1-propen-1-yl]phenyl-D-glucopyranosid [German] [ACD/IUPAC Name]
2-Propenal, 3-[4-(D-glucopyranosyloxy)-3,5-dimethoxyphenyl]-, (2E)- [ACD/Index Name]
D-Glucopyranoside de 2,6-diméthoxy-4-[(1E)-3-oxo-1-propén-1-yl]phényle [French] [ACD/IUPAC Name]
sinapaldehyde glucoside
[154461-65-1] [RN]
MFCD20260687
Sinapaldehydeglucoside
sinapyl aldehyde-4-O-&β;-D-glucopyranoside

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

Density: 1.4±0.1 g/cm3
Boiling Point: 633.5±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.0 mmHg at 25°C
Enthalpy of Vaporization: 98.4±3.0 kJ/mol
Flash Point: 229.2±25.0 °C
Index of Refraction: 1.612
Molar Refractivity: 91.4±0.3 cm3
#H bond acceptors: 9
#H bond donors: 4
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 0
ACD/LogP: -1.51
ACD/LogD (pH 5.5): -1.06
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 6.28
ACD/LogD (pH 7.4): -1.06
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 6.28
Polar Surface Area: 135 Å2
Polarizability: 36.2±0.5 10-24cm3
Surface Tension: 57.1±3.0 dyne/cm
Molar Volume: 262.8±3.0 cm3

Click to predict properties on the Chemicalize site


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