ChemSpider 2D Image | (3-{[Bis(4-isobutylphenyl)methyl]amino}phenyl)[1-(4,4-dihydroxy-3-buten-1-yl)-1H-indol-3-yl]methanone | C40H44N2O3

(3-{[Bis(4-isobutylphenyl)methyl]amino}phenyl)[1-(4,4-dihydroxy-3-buten-1-yl)-1H-indol-3-yl]methanone

  • Molecular FormulaC40H44N2O3
  • Average mass600.789 Da
  • Monoisotopic mass600.335205 Da
  • ChemSpider ID95558801

More details:

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

(3-{[Bis(4-isobutylphenyl)methyl]amino}phenyl)[1-(4,4-dihydroxy-3-buten-1-yl)-1H-indol-3-yl]methanon [German] [ACD/IUPAC Name]
(3-{[Bis(4-isobutylphenyl)methyl]amino}phenyl)[1-(4,4-dihydroxy-3-buten-1-yl)-1H-indol-3-yl]methanone [ACD/IUPAC Name]
(3-{[Bis(4-isobutylphényl)méthyl]amino}phényl)[1-(4,4-dihydroxy-3-butén-1-yl)-1H-indol-3-yl]méthanone [French] [ACD/IUPAC Name]
Methanone, [3-[[bis[4-(2-methylpropyl)phenyl]methyl]amino]phenyl][1-(4,4-dihydroxy-3-buten-1-yl)-1H-indol-3-yl]- [ACD/Index 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: 794.5±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.9 mmHg at 25°C
Enthalpy of Vaporization: 121.2±3.0 kJ/mol
Flash Point: 434.3±32.9 °C
Index of Refraction: 1.598
Molar Refractivity: 183.0±0.5 cm3
#H bond acceptors: 5
#H bond donors: 3
#Freely Rotating Bonds: 13
#Rule of 5 Violations: 2
ACD/LogP: 10.40
ACD/LogD (pH 5.5): 8.38
ACD/BCF (pH 5.5): 1000000.00
ACD/KOC (pH 5.5): 860678.88
ACD/LogD (pH 7.4): 8.38
ACD/BCF (pH 7.4): 1000000.00
ACD/KOC (pH 7.4): 858439.38
Polar Surface Area: 74 Å2
Polarizability: 72.5±0.5 10-24cm3
Surface Tension: 42.0±7.0 dyne/cm
Molar Volume: 536.6±7.0 cm3

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