ChemSpider 2D Image | N-{2-[4-({5-(Benzyloxy)-2-[4-(benzyloxy)phenyl]-3-methyl-1H-indol-1-yl}methyl)phenoxy]ethyl}-N-methyl-1-butanamine | C43H46N2O3

N-{2-[4-({5-(Benzyloxy)-2-[4-(benzyloxy)phenyl]-3-methyl-1H-indol-1-yl}methyl)phenoxy]ethyl}-N-methyl-1-butanamine

  • Molecular FormulaC43H46N2O3
  • Average mass638.837 Da
  • Monoisotopic mass638.350830 Da
  • ChemSpider ID8093026

More details:

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

1-Butanamine, N-methyl-N-[2-[4-[[3-methyl-5-(phenylmethoxy)-2-[4-(phenylmethoxy)phenyl]-1H-indol-1-yl]methyl]phenoxy]ethyl]- [ACD/Index Name]
N-{2-[4-({5-(Benzyloxy)-2-[4-(benzyloxy)phenyl]-3-methyl-1H-indol-1-yl}methyl)phenoxy]ethyl}-N-methyl-1-butanamin [German] [ACD/IUPAC Name]
N-{2-[4-({5-(Benzyloxy)-2-[4-(benzyloxy)phenyl]-3-methyl-1H-indol-1-yl}methyl)phenoxy]ethyl}-N-methyl-1-butanamine [ACD/IUPAC Name]
N-{2-[4-({5-(Benzyloxy)-2-[4-(benzyloxy)phényl]-3-méthyl-1H-indol-1-yl}méthyl)phénoxy]éthyl}-N-méthyl-1-butanamine [French] [ACD/IUPAC Name]

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

Density: 1.1±0.1 g/cm3
Boiling Point: 781.6±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.7 mmHg at 25°C
Enthalpy of Vaporization: 113.7±3.0 kJ/mol
Flash Point: 426.5±32.9 °C
Index of Refraction: 1.581
Molar Refractivity: 197.0±0.5 cm3
#H bond acceptors: 5
#H bond donors: 0
#Freely Rotating Bonds: 16
#Rule of 5 Violations: 2
ACD/LogP: 11.02
ACD/LogD (pH 5.5): 6.87
ACD/BCF (pH 5.5): 19855.36
ACD/KOC (pH 5.5): 6320.45
ACD/LogD (pH 7.4): 8.36
ACD/BCF (pH 7.4): 622608.75
ACD/KOC (pH 7.4): 198191.63
Polar Surface Area: 36 Å2
Polarizability: 78.1±0.5 10-24cm3
Surface Tension: 40.4±7.0 dyne/cm
Molar Volume: 590.7±7.0 cm3

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