ChemSpider 2D Image | N,N-Dibenzyl-2-[(2-hydroxy-4-oxo-4H-chromen-3-yl)(phenyl)methyl]-3-oxo-1-butanaminium | C34H32NO4

N,N-Dibenzyl-2-[(2-hydroxy-4-oxo-4H-chromen-3-yl)(phenyl)methyl]-3-oxo-1-butanaminium

  • Molecular FormulaC34H32NO4
  • Average mass518.622 Da
  • Monoisotopic mass518.232605 Da
  • ChemSpider ID3584181

  • Charge - Charge

More details:

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

4H-1-Benzopyran-3-propanaminium, β-acetyl-2-hydroxy-4-oxo-γ-phenyl-N,N-bis(phenylmethyl)- [ACD/Index Name]
N,N-Dibenzyl-2-[(2-hydroxy-4-oxo-4H-chromen-3-yl)(phenyl)methyl]-3-oxo-1-butanaminium [ACD/IUPAC Name]
N,N-Dibenzyl-2-[(2-hydroxy-4-oxo-4H-chromen-3-yl)(phenyl)methyl]-3-oxo-1-butanaminium [German] [ACD/IUPAC Name]
N,N-Dibenzyl-2-[(2-hydroxy-4-oxo-4H-chromén-3-yl)(phényl)méthyl]-3-oxo-1-butanaminium [French] [ACD/IUPAC Name]

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

Density:
Boiling Point: 664.5±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.1 mmHg at 25°C
Enthalpy of Vaporization: 102.7±3.0 kJ/mol
Flash Point: 355.7±31.5 °C
Index of Refraction:
Molar Refractivity:
#H bond acceptors: 5
#H bond donors: 1
#Freely Rotating Bonds: 10
#Rule of 5 Violations: 2
ACD/LogP: 7.64
ACD/LogD (pH 5.5): 3.86
ACD/BCF (pH 5.5): 161.54
ACD/KOC (pH 5.5): 340.31
ACD/LogD (pH 7.4): 3.20
ACD/BCF (pH 7.4): 35.31
ACD/KOC (pH 7.4): 74.38
Polar Surface Area: 68 Å2
Polarizability:
Surface Tension:
Molar Volume:

Click to predict properties on the Chemicalize site


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