ChemSpider 2D Image | N-[2-(2-sec-Butylphenoxy)propyl]-3-(2-phenoxyethoxy)aniline | C27H33NO3

N-[2-(2-sec-Butylphenoxy)propyl]-3-(2-phenoxyethoxy)aniline

  • Molecular FormulaC27H33NO3
  • Average mass419.556 Da
  • Monoisotopic mass419.246033 Da
  • ChemSpider ID21330870

More details:

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

1040686-51-8 [RN]
3-(2-phenoxyethoxy)-N-{2-[2-(sec-butyl)phenoxy]propyl}aniline
Benzenamine, N-[2-[2-(1-methylpropyl)phenoxy]propyl]-3-(2-phenoxyethoxy)- [ACD/Index Name]
N-[2-(2-sec-Butylphenoxy)propyl]-3-(2-phenoxyethoxy)anilin [German] [ACD/IUPAC Name]
N-[2-(2-sec-Butylphenoxy)propyl]-3-(2-phenoxyethoxy)aniline [ACD/IUPAC Name]
N-[2-(2-sec-Butylphénoxy)propyl]-3-(2-phénoxyéthoxy)aniline [French] [ACD/IUPAC Name]
N-{2-[2-(butan-2-yl)phenoxy]propyl}-3-(2-phenoxyethoxy)aniline
MFCD10688107 [MDL number]
N-(2-(2-(sec-butyl)phenoxy)propyl)-3-(2-phenoxyethoxy)aniline
N-[2-(2-butan-2-ylphenoxy)propyl]-3-(2-phenoxyethoxy)aniline
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Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

Density: 1.1±0.1 g/cm3
Boiling Point: 575.4±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.6 mmHg at 25°C
Enthalpy of Vaporization: 86.2±3.0 kJ/mol
Flash Point: 249.8±19.6 °C
Index of Refraction: 1.576
Molar Refractivity: 127.7±0.3 cm3
#H bond acceptors: 4
#H bond donors: 1
#Freely Rotating Bonds: 12
#Rule of 5 Violations: 1
ACD/LogP: 6.93
ACD/LogD (pH 5.5): 6.81
ACD/BCF (pH 5.5): 87341.43
ACD/KOC (pH 5.5): 119140.09
ACD/LogD (pH 7.4): 6.82
ACD/BCF (pH 7.4): 89067.63
ACD/KOC (pH 7.4): 121494.76
Polar Surface Area: 40 Å2
Polarizability: 50.6±0.5 10-24cm3
Surface Tension: 41.2±3.0 dyne/cm
Molar Volume: 386.2±3.0 cm3

Click to predict properties on the Chemicalize site


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