ChemSpider 2D Image | 2-Isobutoxy-N-(4-isopropoxybenzyl)aniline | C20H27NO2

2-Isobutoxy-N-(4-isopropoxybenzyl)aniline

  • Molecular FormulaC20H27NO2
  • Average mass313.434 Da
  • Monoisotopic mass313.204193 Da
  • ChemSpider ID21330779

More details:

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

1040694-63-0 [RN]
2-(2-methylpropoxy)-N-{[4-(propan-2-yloxy)phenyl]methyl}aniline
2-Isobutoxy-N-(4-isopropoxybenzyl)anilin [German] [ACD/IUPAC Name]
2-Isobutoxy-N-(4-isopropoxybenzyl)aniline [ACD/IUPAC Name]
2-Isobutoxy-N-(4-isopropoxybenzyl)aniline [French] [ACD/IUPAC Name]
Benzenemethanamine, 4-(1-methylethoxy)-N-[2-(2-methylpropoxy)phenyl]- [ACD/Index Name]
N-[(4-isopropoxyphenyl)methyl]-2-(2-methylpropoxy)aniline
(2-isobutoxyphenyl)(4-isopropoxybenzyl)amine
2-(2-methylpropoxy)-N-[(4-propan-2-yloxyphenyl)methyl]aniline
MFCD10688018 [MDL number]

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

Density: 1.0±0.1 g/cm3
Boiling Point: 424.7±25.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.0 mmHg at 25°C
Enthalpy of Vaporization: 67.9±3.0 kJ/mol
Flash Point: 185.9±12.6 °C
Index of Refraction: 1.557
Molar Refractivity: 96.8±0.3 cm3
#H bond acceptors: 3
#H bond donors: 1
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 1
ACD/LogP: 5.55
ACD/LogD (pH 5.5): 5.03
ACD/BCF (pH 5.5): 3179.38
ACD/KOC (pH 5.5): 8779.40
ACD/LogD (pH 7.4): 5.39
ACD/BCF (pH 7.4): 7325.67
ACD/KOC (pH 7.4): 20228.80
Polar Surface Area: 30 Å2
Polarizability: 38.4±0.5 10-24cm3
Surface Tension: 37.7±3.0 dyne/cm
Molar Volume: 300.9±3.0 cm3

Click to predict properties on the Chemicalize site


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