ChemSpider 2D Image | Diethyl [hexadecyl(2-hydroxy-5-nitrophenyl)amino]malonate | C29H48N2O7

Diethyl [hexadecyl(2-hydroxy-5-nitrophenyl)amino]malonate

  • Molecular FormulaC29H48N2O7
  • Average mass536.701 Da
  • Monoisotopic mass536.346130 Da
  • ChemSpider ID108636276

More details:

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

[Hexadécyl(2-hydroxy-5-nitrophényl)amino]malonate de diéthyle [French] [ACD/IUPAC Name]
Diethyl [hexadecyl(2-hydroxy-5-nitrophenyl)amino]malonate [ACD/IUPAC Name]
Diethyl-[hexadecyl(2-hydroxy-5-nitrophenyl)amino]malonat [German] [ACD/IUPAC Name]
Propanedioic acid, 2-[hexadecyl(2-hydroxy-5-nitrophenyl)amino]-, diethyl ester [ACD/Index Name]

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

Density: 1.1±0.1 g/cm3
Boiling Point: 616.2±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.8 mmHg at 25°C
Enthalpy of Vaporization: 94.8±3.0 kJ/mol
Flash Point: 326.5±31.5 °C
Index of Refraction: 1.521
Molar Refractivity: 149.8±0.3 cm3
#H bond acceptors: 9
#H bond donors: 1
#Freely Rotating Bonds: 24
#Rule of 5 Violations: 2
ACD/LogP: 10.89
ACD/LogD (pH 5.5): 9.95
ACD/BCF (pH 5.5): 1000000.00
ACD/KOC (pH 5.5): 5791565.00
ACD/LogD (pH 7.4): 8.89
ACD/BCF (pH 7.4): 1000000.00
ACD/KOC (pH 7.4): 503293.50
Polar Surface Area: 122 Å2
Polarizability: 59.4±0.5 10-24cm3
Surface Tension: 43.4±3.0 dyne/cm
Molar Volume: 491.7±3.0 cm3

Click to predict properties on the Chemicalize site


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