ChemSpider 2D Image | 2-[Hexadecyl(3-nitrophenyl)amino]octanoic acid | C30H52N2O4

2-[Hexadecyl(3-nitrophenyl)amino]octanoic acid

  • Molecular FormulaC30H52N2O4
  • Average mass504.745 Da
  • Monoisotopic mass504.392700 Da
  • ChemSpider ID102729341

More details:

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

2-[Hexadecyl(3-nitrophenyl)amino]octanoic acid [ACD/IUPAC Name]
2-[Hexadecyl(3-nitrophenyl)amino]octansäure [German] [ACD/IUPAC Name]
Acide 2-[hexadécyl(3-nitrophényl)amino]octanoïque [French] [ACD/IUPAC Name]
Octanoic acid, 2-[hexadecyl(3-nitrophenyl)amino]- [ACD/Index Name]

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

Density: 1.0±0.1 g/cm3
Boiling Point: 620.4±35.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.9 mmHg at 25°C
Enthalpy of Vaporization: 96.7±3.0 kJ/mol
Flash Point: 329.0±25.9 °C
Index of Refraction: 1.517
Molar Refractivity: 150.6±0.3 cm3
#H bond acceptors: 6
#H bond donors: 1
#Freely Rotating Bonds: 24
#Rule of 5 Violations: 2
ACD/LogP: 12.91
ACD/LogD (pH 5.5): 10.29
ACD/BCF (pH 5.5): 1000000.00
ACD/KOC (pH 5.5): 1715873.00
ACD/LogD (pH 7.4): 8.60
ACD/BCF (pH 7.4): 324908.94
ACD/KOC (pH 7.4): 35209.74
Polar Surface Area: 86 Å2
Polarizability: 59.7±0.5 10-24cm3
Surface Tension: 41.1±3.0 dyne/cm
Molar Volume: 497.4±3.0 cm3

Click to predict properties on the Chemicalize site


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