ChemSpider 2D Image | 2-{4-[(6-Ethoxy-2-oxo-2H-chromen-4-yl)methyl]-1-piperazinyl}-N-mesitylacetamide | C27H33N3O4

2-{4-[(6-Ethoxy-2-oxo-2H-chromen-4-yl)methyl]-1-piperazinyl}-N-mesitylacetamide

  • Molecular FormulaC27H33N3O4
  • Average mass463.569 Da
  • Monoisotopic mass463.247101 Da
  • ChemSpider ID21638212

More details:

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

1-Piperazineacetamide, 4-[(6-ethoxy-2-oxo-2H-1-benzopyran-4-yl)methyl]-N-(2,4,6-trimethylphenyl)- [ACD/Index Name]
2-{4-[(6-Ethoxy-2-oxo-2H-chromen-4-yl)methyl]-1-piperazinyl}-N-mesitylacetamid [German] [ACD/IUPAC Name]
2-{4-[(6-Ethoxy-2-oxo-2H-chromen-4-yl)methyl]-1-piperazinyl}-N-mesitylacetamide [ACD/IUPAC Name]
2-{4-[(6-Éthoxy-2-oxo-2H-chromén-4-yl)méthyl]-1-pipérazinyl}-N-mésitylacétamide [French] [ACD/IUPAC Name]
2-{4-[(6-Ethoxy-2-oxo-2H-chromen-4-yl)methyl]piperazin-1-yl}-N-mesitylacetamide
2-[4-(6-Ethoxy-2-oxo-2H-chromen-4-ylmethyl)-piperazin-1-yl]-N-(2,4,6-trimethyl-phenyl)-acetamide
2-{4-[(6-ethoxy-2-oxo-2H-chromen-4-yl)methyl]piperazin-1-yl}-N-(2,4,6-trimethylphenyl)acetamide
2-{4-[(6-ethoxy-2-oxochromen-4-yl)methyl]piperazinyl}-N-(2,4,6-trimethylphenyl)acetamide
MFCD09779994

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

Density: 1.2±0.1 g/cm3
Boiling Point: 650.2±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.9 mmHg at 25°C
Enthalpy of Vaporization: 95.8±3.0 kJ/mol
Flash Point: 347.0±31.5 °C
Index of Refraction: 1.603
Molar Refractivity: 132.4±0.3 cm3
#H bond acceptors: 7
#H bond donors: 1
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 0
ACD/LogP: 4.88
ACD/LogD (pH 5.5): 2.86
ACD/BCF (pH 5.5): 56.49
ACD/KOC (pH 5.5): 367.45
ACD/LogD (pH 7.4): 3.65
ACD/BCF (pH 7.4): 341.98
ACD/KOC (pH 7.4): 2224.30
Polar Surface Area: 71 Å2
Polarizability: 52.5±0.5 10-24cm3
Surface Tension: 50.4±3.0 dyne/cm
Molar Volume: 385.2±3.0 cm3

Click to predict properties on the Chemicalize site


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