ChemSpider 2D Image | N-(4-Hydroxycyclohexyl)-3-(4-hydroxy-6-methyl-2-oxo-2H-pyran-3-yl)-3-(2,3,4-trimethoxyphenyl)propanamide | C24H31NO8

N-(4-Hydroxycyclohexyl)-3-(4-hydroxy-6-methyl-2-oxo-2H-pyran-3-yl)-3-(2,3,4-trimethoxyphenyl)propanamide

  • Molecular FormulaC24H31NO8
  • Average mass461.505 Da
  • Monoisotopic mass461.204956 Da
  • ChemSpider ID44206041

More details:

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

2H-Pyran-3-propanamide, 4-hydroxy-N-(4-hydroxycyclohexyl)-6-methyl-2-oxo-β-(2,3,4-trimethoxyphenyl)- [ACD/Index Name]
N-(4-Hydroxycyclohexyl)-3-(4-hydroxy-6-methyl-2-oxo-2H-pyran-3-yl)-3-(2,3,4-trimethoxyphenyl)propanamid [German] [ACD/IUPAC Name]
N-(4-Hydroxycyclohexyl)-3-(4-hydroxy-6-methyl-2-oxo-2H-pyran-3-yl)-3-(2,3,4-trimethoxyphenyl)propanamide [ACD/IUPAC Name]
N-(4-Hydroxycyclohexyl)-3-(4-hydroxy-6-méthyl-2-oxo-2H-pyran-3-yl)-3-(2,3,4-triméthoxyphényl)propanamide [French] [ACD/IUPAC Name]
3-(4-hydroxy-6-methyl-2-oxo-2H-pyran-3-yl)-N-(4-hydroxycyclohexyl)-3-(2,3,4-trimethoxyphenyl)propanamide

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

Density: 1.3±0.1 g/cm3
Boiling Point: 709.0±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.4 mmHg at 25°C
Enthalpy of Vaporization: 108.9±3.0 kJ/mol
Flash Point: 382.6±32.9 °C
Index of Refraction: 1.589
Molar Refractivity: 119.0±0.4 cm3
#H bond acceptors: 9
#H bond donors: 3
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 0
ACD/LogP: 1.13
ACD/LogD (pH 5.5): 0.65
ACD/BCF (pH 5.5): 1.30
ACD/KOC (pH 5.5): 28.05
ACD/LogD (pH 7.4): -1.10
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 124 Å2
Polarizability: 47.2±0.5 10-24cm3
Surface Tension: 57.4±5.0 dyne/cm
Molar Volume: 353.2±5.0 cm3

Click to predict properties on the Chemicalize site


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