ChemSpider 2D Image | Methyl 3-(4-hydroxy-3,5-dimethoxyphenyl)-3-[2-hydroxy-1-(3-methoxypropyl)-6-methyl-4-oxo-1,4-dihydro-3-pyridinyl]propanoate | C22H29NO8

Methyl 3-(4-hydroxy-3,5-dimethoxyphenyl)-3-[2-hydroxy-1-(3-methoxypropyl)-6-methyl-4-oxo-1,4-dihydro-3-pyridinyl]propanoate

  • Molecular FormulaC22H29NO8
  • Average mass435.468 Da
  • Monoisotopic mass435.189331 Da
  • ChemSpider ID80540700

More details:

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

3-(4-Hydroxy-3,5-diméthoxyphényl)-3-[2-hydroxy-1-(3-méthoxypropyl)-6-méthyl-4-oxo-1,4-dihydro-3-pyridinyl]propanoate de méthyle [French] [ACD/IUPAC Name]
3-Pyridinepropanoic acid, 1,4-dihydro-2-hydroxy-β-(4-hydroxy-3,5-dimethoxyphenyl)-1-(3-methoxypropyl)-6-methyl-4-oxo-, methyl ester [ACD/Index Name]
Methyl 3-(4-hydroxy-3,5-dimethoxyphenyl)-3-[2-hydroxy-1-(3-methoxypropyl)-6-methyl-4-oxo-1,4-dihydro-3-pyridinyl]propanoate [ACD/IUPAC Name]
Methyl-3-(4-hydroxy-3,5-dimethoxyphenyl)-3-[2-hydroxy-1-(3-methoxypropyl)-6-methyl-4-oxo-1,4-dihydro-3-pyridinyl]propanoat [German] [ACD/IUPAC Name]

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

Density: 1.3±0.1 g/cm3
Boiling Point: 594.3±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.8 mmHg at 25°C
Enthalpy of Vaporization: 93.2±3.0 kJ/mol
Flash Point: 313.2±30.1 °C
Index of Refraction: 1.563
Molar Refractivity: 112.7±0.3 cm3
#H bond acceptors: 9
#H bond donors: 2
#Freely Rotating Bonds: 11
#Rule of 5 Violations: 0
ACD/LogP: 0.81
ACD/LogD (pH 5.5): 0.32
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 14.60
ACD/LogD (pH 7.4): -1.42
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 115 Å2
Polarizability: 44.7±0.5 10-24cm3
Surface Tension: 50.3±3.0 dyne/cm
Molar Volume: 347.0±3.0 cm3

Click to predict properties on the Chemicalize site


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