ChemSpider 2D Image | 9-(1,3-Benzodioxol-5-yl)-6,7-dimethoxy-1-oxo-1,3-dihydronaphtho[2,3-c]furan-4-yl 4-O-acetyl-6-deoxy-beta-L-galactopyranoside | C29H28O12

9-(1,3-Benzodioxol-5-yl)-6,7-dimethoxy-1-oxo-1,3-dihydronaphtho[2,3-c]furan-4-yl 4-O-acetyl-6-deoxy-β-L-galactopyranoside

  • Molecular FormulaC29H28O12
  • Average mass568.525 Da
  • Monoisotopic mass568.158081 Da
  • ChemSpider ID9459477

  • defined stereocentres - 5 of 5 defined stereocentres

More details:

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

4-O-Acétyl-6-désoxy-β-L-galactopyranoside de 9-(1,3-benzodioxol-5-yl)-6,7-diméthoxy-1-oxo-1,3-dihydronaphto[2,3-c]furan-4-yle [French] [ACD/IUPAC Name]
9-(1,3-Benzodioxol-5-yl)-6,7-dimethoxy-1-oxo-1,3-dihydronaphtho[2,3-c]furan-4-yl 4-O-acetyl-6-deoxy-β-L-galactopyranoside [ACD/IUPAC Name]
9-(1,3-Benzodioxol-5-yl)-6,7-dimethoxy-1-oxo-1,3-dihydronaphtho[2,3-c]furan-4-yl-4-O-acetyl-6-desoxy-β-L-galactopyranosid [German] [ACD/IUPAC Name]
Naphtho[2,3-c]furan-1(3H)-one, 4-[(4-O-acetyl-6-deoxy-β-L-galactopyranosyl)oxy]-9-(1,3-benzodioxol-5-yl)-6,7-dimethoxy- [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: 797.2±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.9 mmHg at 25°C
Enthalpy of Vaporization: 121.6±3.0 kJ/mol
Flash Point: 264.8±26.4 °C
Index of Refraction: 1.672
Molar Refractivity: 140.2±0.4 cm3
#H bond acceptors: 12
#H bond donors: 2
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 2
ACD/LogP: 2.29
ACD/LogD (pH 5.5): 2.19
ACD/BCF (pH 5.5): 27.23
ACD/KOC (pH 5.5): 370.57
ACD/LogD (pH 7.4): 2.19
ACD/BCF (pH 7.4): 27.23
ACD/KOC (pH 7.4): 370.56
Polar Surface Area: 148 Å2
Polarizability: 55.6±0.5 10-24cm3
Surface Tension: 74.2±5.0 dyne/cm
Molar Volume: 374.5±5.0 cm3

Click to predict properties on the Chemicalize site


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