ChemSpider 2D Image | N-[2,4-Bis(octyloxy)benzyl]-1-propanamine | C26H47NO2

N-[2,4-Bis(octyloxy)benzyl]-1-propanamine

  • Molecular FormulaC26H47NO2
  • Average mass405.657 Da
  • Monoisotopic mass405.360687 Da
  • ChemSpider ID44824026

More details:

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

Benzenemethanamine, 2,4-bis(octyloxy)-N-propyl- [ACD/Index Name]
N-[2,4-Bis(octyloxy)benzyl]-1-propanamin [German] [ACD/IUPAC Name]
N-[2,4-Bis(octyloxy)benzyl]-1-propanamine [ACD/IUPAC Name]
N-[2,4-Bis(octyloxy)benzyl]-1-propanamine [French] [ACD/IUPAC Name]

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

Density: 0.9±0.1 g/cm3
Boiling Point: 497.6±30.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.3 mmHg at 25°C
Enthalpy of Vaporization: 76.6±3.0 kJ/mol
Flash Point: 231.7±14.0 °C
Index of Refraction: 1.484
Molar Refractivity: 126.9±0.3 cm3
#H bond acceptors: 3
#H bond donors: 1
#Freely Rotating Bonds: 20
#Rule of 5 Violations: 1
ACD/LogP: 9.73
ACD/LogD (pH 5.5): 5.82
ACD/BCF (pH 5.5): 2897.67
ACD/KOC (pH 5.5): 1434.30
ACD/LogD (pH 7.4): 6.88
ACD/BCF (pH 7.4): 33373.75
ACD/KOC (pH 7.4): 16519.40
Polar Surface Area: 30 Å2
Polarizability: 50.3±0.5 10-24cm3
Surface Tension: 32.9±3.0 dyne/cm
Molar Volume: 443.2±3.0 cm3

Click to predict properties on the Chemicalize site


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