ChemSpider 2D Image | 2-{[4-(Diethylamino)-1-piperidinyl]methyl}-4,6-diiodophenol | C16H24I2N2O

2-{[4-(Diethylamino)-1-piperidinyl]methyl}-4,6-diiodophenol

  • Molecular FormulaC16H24I2N2O
  • Average mass514.183 Da
  • Monoisotopic mass513.997803 Da
  • ChemSpider ID35034207

More details:

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

2-{[4-(Diethylamino)-1-piperidinyl]methyl}-4,6-diiodophenol [ACD/IUPAC Name]
2-{[4-(Diéthylamino)-1-pipéridinyl]méthyl}-4,6-diiodophénol [French] [ACD/IUPAC Name]
2-{[4-(Diethylamino)-1-piperidinyl]methyl}-4,6-diiodphenol [German] [ACD/IUPAC Name]
2-{[4-(Diethylamino)piperidin-1-Yl]methyl}-4,6-Diiodophenol
Phenol, 2-[[4-(diethylamino)-1-piperidinyl]methyl]-4,6-diiodo- [ACD/Index Name]
P86

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

Density: 1.8±0.1 g/cm3
Boiling Point: 456.2±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.2 mmHg at 25°C
Enthalpy of Vaporization: 74.4±3.0 kJ/mol
Flash Point: 229.7±28.7 °C
Index of Refraction: 1.668
Molar Refractivity: 106.1±0.4 cm3
#H bond acceptors: 3
#H bond donors: 1
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 1
ACD/LogP: 4.55
ACD/LogD (pH 5.5): 1.28
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 3.77
ACD/LogD (pH 7.4): 2.18
ACD/BCF (pH 7.4): 7.25
ACD/KOC (pH 7.4): 30.46
Polar Surface Area: 27 Å2
Polarizability: 42.1±0.5 10-24cm3
Surface Tension: 58.7±5.0 dyne/cm
Molar Volume: 284.8±5.0 cm3

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