ChemSpider 2D Image | N-({(2E)-6-Hydroxy-2-[(5-methyl-2-furyl)methylene]-3-oxo-2,3-dihydro-1-benzofuran-7-yl}methyl)-N-methyl-1-butanaminium | C20H24NO4

N-({(2E)-6-Hydroxy-2-[(5-methyl-2-furyl)methylene]-3-oxo-2,3-dihydro-1-benzofuran-7-yl}methyl)-N-methyl-1-butanaminium

  • Molecular FormulaC20H24NO4
  • Average mass342.408 Da
  • Monoisotopic mass342.169983 Da
  • ChemSpider ID21219437

  • Charge - Charge

    Double-bond stereo - Double-bond stereo

More details:

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

7-Benzofuranmethanaminium, N-butyl-2,3-dihydro-6-hydroxy-N-methyl-2-[(5-methyl-2-furanyl)methylene]-3-oxo-, (2E)- [ACD/Index Name]
N-({(2E)-6-Hydroxy-2-[(5-methyl-2-furyl)methylen]-3-oxo-2,3-dihydro-1-benzofuran-7-yl}methyl)-N-methyl-1-butanaminium [German] [ACD/IUPAC Name]
N-({(2E)-6-Hydroxy-2-[(5-methyl-2-furyl)methylene]-3-oxo-2,3-dihydro-1-benzofuran-7-yl}methyl)-N-methyl-1-butanaminium [ACD/IUPAC Name]
N-({(2E)-6-Hydroxy-2-[(5-méthyl-2-furyl)méthylène]-3-oxo-2,3-dihydro-1-benzofuran-7-yl}méthyl)-N-méthyl-1-butanaminium [French] [ACD/IUPAC Name]

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

Density:
Boiling Point: 504.4±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.3 mmHg at 25°C
Enthalpy of Vaporization: 80.3±3.0 kJ/mol
Flash Point: 258.9±30.1 °C
Index of Refraction:
Molar Refractivity:
#H bond acceptors: 5
#H bond donors: 1
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 0
ACD/LogP: 4.41
ACD/LogD (pH 5.5): 1.34
ACD/BCF (pH 5.5): 1.51
ACD/KOC (pH 5.5): 8.86
ACD/LogD (pH 7.4): 2.35
ACD/BCF (pH 7.4): 15.58
ACD/KOC (pH 7.4): 91.55
Polar Surface Area: 64 Å2
Polarizability:
Surface Tension:
Molar Volume:

Click to predict properties on the Chemicalize site


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