ChemSpider 2D Image | (2E)-6-Methoxy-2-[4-(pentyloxy)benzylidene]-3,4-dihydro-1(2H)-naphthalenone | C23H26O3

(2E)-6-Methoxy-2-[4-(pentyloxy)benzylidene]-3,4-dihydro-1(2H)-naphthalenone

  • Molecular FormulaC23H26O3
  • Average mass350.451 Da
  • Monoisotopic mass350.188202 Da
  • ChemSpider ID22947329
  • Double-bond stereo - Double-bond stereo


More details:






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

(2E)-6-Methoxy-2-[4-(pentyloxy)benzyliden]-3,4-dihydro-1(2H)-naphthalinon [German] [ACD/IUPAC Name]
(2E)-6-Méthoxy-2-[4-(pentyloxy)benzylidène]-3,4-dihydro-1(2H)-naphtalénone [French] [ACD/IUPAC Name]
(2E)-6-Methoxy-2-[4-(pentyloxy)benzylidene]-3,4-dihydro-1(2H)-naphthalenone [ACD/IUPAC Name]
1(2H)-Naphthalenone, 3,4-dihydro-6-methoxy-2-[[4-(pentyloxy)phenyl]methylene]-, (2E)- [ACD/Index Name]

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module

Density: 1.1±0.1 g/cm3
Boiling Point: 533.4±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.4 mmHg at 25°C
Enthalpy of Vaporization: 80.9±3.0 kJ/mol
Flash Point: 269.0±16.5 °C
Index of Refraction: 1.587
Molar Refractivity: 105.7±0.3 cm3
#H bond acceptors: 3
#H bond donors: 0
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 1
ACD/LogP: 6.84
ACD/LogD (pH 5.5): 6.47
ACD/BCF (pH 5.5): 48260.77
ACD/KOC (pH 5.5): 78360.78
ACD/LogD (pH 7.4): 6.47
ACD/BCF (pH 7.4): 48260.77
ACD/KOC (pH 7.4): 78360.78
Polar Surface Area: 36 Å2
Polarizability: 41.9±0.5 10-24cm3
Surface Tension: 44.6±3.0 dyne/cm
Molar Volume: 314.6±3.0 cm3

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