ChemSpider 2D Image | N-Cyclooctyl-6-(4-hydroxy-6-methoxy-7-methyl-3-oxo-1,3-dihydro-2-benzofuran-5-yl)-4-methyl-4-hexenamide | C25H35NO5

N-Cyclooctyl-6-(4-hydroxy-6-methoxy-7-methyl-3-oxo-1,3-dihydro-2-benzofuran-5-yl)-4-methyl-4-hexenamide

  • Molecular FormulaC25H35NO5
  • Average mass429.549 Da
  • Monoisotopic mass429.251526 Da
  • ChemSpider ID35312662

More details:

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

4-Hexenamide, N-cyclooctyl-6-(1,3-dihydro-4-hydroxy-6-methoxy-7-methyl-3-oxo-5-isobenzofuranyl)-4-methyl- [ACD/Index Name]
N-Cyclooctyl-6-(4-hydroxy-6-methoxy-7-methyl-3-oxo-1,3-dihydro-2-benzofuran-5-yl)-4-methyl-4-hexenamid [German] [ACD/IUPAC Name]
N-Cyclooctyl-6-(4-hydroxy-6-methoxy-7-methyl-3-oxo-1,3-dihydro-2-benzofuran-5-yl)-4-methyl-4-hexenamide [ACD/IUPAC Name]
N-Cyclooctyl-6-(4-hydroxy-6-méthoxy-7-méthyl-3-oxo-1,3-dihydro-2-benzofuran-5-yl)-4-méthyl-4-hexénamide [French] [ACD/IUPAC Name]

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

Density: 1.2±0.1 g/cm3
Boiling Point: 699.8±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.3 mmHg at 25°C
Enthalpy of Vaporization: 106.1±3.0 kJ/mol
Flash Point: 377.1±31.5 °C
Index of Refraction: 1.567
Molar Refractivity: 119.2±0.4 cm3
#H bond acceptors: 6
#H bond donors: 2
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 1
ACD/LogP: 5.35
ACD/LogD (pH 5.5): 5.15
ACD/BCF (pH 5.5): 4801.46
ACD/KOC (pH 5.5): 15021.52
ACD/LogD (pH 7.4): 5.14
ACD/BCF (pH 7.4): 4785.85
ACD/KOC (pH 7.4): 14972.70
Polar Surface Area: 85 Å2
Polarizability: 47.2±0.5 10-24cm3
Surface Tension: 51.0±5.0 dyne/cm
Molar Volume: 365.0±5.0 cm3

Click to predict properties on the Chemicalize site


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