ChemSpider 2D Image | 3-(4-Methoxyphenyl)-4-oxo-4H-chromen-6-yl 2,3,4,6-tetra-O-acetyl-alpha-L-talopyranoside | C30H30O13

3-(4-Methoxyphenyl)-4-oxo-4H-chromen-6-yl 2,3,4,6-tetra-O-acetyl-α-L-talopyranoside

  • Molecular FormulaC30H30O13
  • Average mass598.551 Da
  • Monoisotopic mass598.168640 Da
  • ChemSpider ID5036898

  • defined stereocentres - 5 of 5 defined stereocentres

More details:

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

2,3,4,6-Tétra-O-acétyl-α-L-talopyranoside de 3-(4-méthoxyphényl)-4-oxo-4H-chromén-6-yle [French] [ACD/IUPAC Name]
3-(4-Methoxyphenyl)-4-oxo-4H-chromen-6-yl 2,3,4,6-tetra-O-acetyl-α-L-talopyranoside [ACD/IUPAC Name]
3-(4-Methoxyphenyl)-4-oxo-4H-chromen-6-yl-2,3,4,6-tetra-O-acetyl-α-L-talopyranosid [German] [ACD/IUPAC Name]
4H-1-Benzopyran-4-one, 3-(4-methoxyphenyl)-6-[(2,3,4,6-tetra-O-acetyl-α-L-talopyranosyl)oxy]- [ACD/Index Name]

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

NCGC00017274-01 [DBID]
TNP00184 [DBID]

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

Density: 1.4±0.1 g/cm3
Boiling Point: 687.9±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.1 mmHg at 25°C
Enthalpy of Vaporization: 100.8±3.0 kJ/mol
Flash Point: 287.3±31.5 °C
Index of Refraction: 1.585
Molar Refractivity: 144.8±0.4 cm3
#H bond acceptors: 13
#H bond donors: 0
#Freely Rotating Bonds: 13
#Rule of 5 Violations: 2
ACD/LogP: 4.31
ACD/LogD (pH 5.5): 3.79
ACD/BCF (pH 5.5): 448.14
ACD/KOC (pH 5.5): 2750.95
ACD/LogD (pH 7.4): 3.79
ACD/BCF (pH 7.4): 448.14
ACD/KOC (pH 7.4): 2750.95
Polar Surface Area: 159 Å2
Polarizability: 57.4±0.5 10-24cm3
Surface Tension: 58.9±5.0 dyne/cm
Molar Volume: 431.9±5.0 cm3

Click to predict properties on the Chemicalize site


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