ChemSpider 2D Image | N-[2-(2-sec-Butylphenoxy)propyl]-2-isopropoxyaniline | C22H31NO2

N-[2-(2-sec-Butylphenoxy)propyl]-2-isopropoxyaniline

  • Molecular FormulaC22H31NO2
  • Average mass341.487 Da
  • Monoisotopic mass341.235474 Da
  • ChemSpider ID21330178

More details:

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

1040683-78-0 [RN]
2-isopropoxy-N-{2-[2-(sec-butyl)phenoxy]propyl}aniline
Benzenamine, 2-(1-methylethoxy)-N-[2-[2-(1-methylpropyl)phenoxy]propyl]- [ACD/Index Name]
N-[2-(2-sec-Butylphenoxy)propyl]-2-isopropoxyanilin [German] [ACD/IUPAC Name]
N-[2-(2-sec-Butylphenoxy)propyl]-2-isopropoxyaniline [ACD/IUPAC Name]
N-[2-(2-sec-Butylphénoxy)propyl]-2-isopropoxyaniline [French] [ACD/IUPAC Name]
N-{2-[2-(butan-2-yl)phenoxy]propyl}-2-(propan-2-yloxy)aniline
MFCD10687431 [MDL number]
N-(2-(2-(sec-butyl)phenoxy)propyl)-2-isopropoxyaniline
N-[2-(2-butan-2-ylphenoxy)propyl]-2-propan-2-yloxyaniline
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Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

Density: 1.0±0.1 g/cm3
Boiling Point: 469.2±35.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.2 mmHg at 25°C
Enthalpy of Vaporization: 73.1±3.0 kJ/mol
Flash Point: 206.2±15.4 °C
Index of Refraction: 1.547
Molar Refractivity: 106.1±0.3 cm3
#H bond acceptors: 3
#H bond donors: 1
#Freely Rotating Bonds: 9
#Rule of 5 Violations: 1
ACD/LogP: 6.63
ACD/LogD (pH 5.5): 5.41
ACD/BCF (pH 5.5): 4900.00
ACD/KOC (pH 5.5): 9144.76
ACD/LogD (pH 7.4): 6.16
ACD/BCF (pH 7.4): 27779.27
ACD/KOC (pH 7.4): 51843.86
Polar Surface Area: 30 Å2
Polarizability: 42.0±0.5 10-24cm3
Surface Tension: 36.7±3.0 dyne/cm
Molar Volume: 334.6±3.0 cm3

Click to predict properties on the Chemicalize site


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