ChemSpider 2D Image | 1-[(E)-{[(3,5,7-Trimethyladamantan-1-yl)methyl]imino}methyl]-2-naphthol | C25H31NO

1-[(E)-{[(3,5,7-Trimethyladamantan-1-yl)methyl]imino}methyl]-2-naphthol

  • Molecular FormulaC25H31NO
  • Average mass361.520 Da
  • Monoisotopic mass361.240570 Da
  • ChemSpider ID21537678
  • Double-bond stereo - Double-bond stereo


More details:






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

1-[(E)-{[(3,5,7-Trimethyladamantan-1-yl)methyl]imino}methyl]-2-naphthol [ACD/IUPAC Name]
1-[(E)-{[(3,5,7-Trimethyladamantan-1-yl)methyl]imino}methyl]-2-naphthol [German] [ACD/IUPAC Name]
1-[(E)-{[(3,5,7-Triméthyladamantan-1-yl)méthyl]imino}méthyl]-2-naphtol [French] [ACD/IUPAC Name]
2-Naphthalenol, 1-[(E)-[[(3,5,7-trimethyltricyclo[3.3.1.13,7]dec-1-yl)methyl]imino]methyl]- [ACD/Index Name]
1-({[(3,5,7-trimethyl-1-adamantyl)methyl]imino}methyl)-2-naphthol
1-[(E)-(3,5,7-TRIMETHYL-1-ADAMANTYL)METHYLIMINOMETHYL]NAPHTHALEN-2-OL

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

Density: 1.2±0.1 g/cm3
Boiling Point: 489.9±28.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.3 mmHg at 25°C
Enthalpy of Vaporization: 78.5±3.0 kJ/mol
Flash Point: 325.6±13.3 °C
Index of Refraction: 1.624
Molar Refractivity: 110.5±0.5 cm3
#H bond acceptors: 2
#H bond donors: 1
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 1
ACD/LogP: 7.69
ACD/LogD (pH 5.5): 6.40
ACD/BCF (pH 5.5): 30314.86
ACD/KOC (pH 5.5): 36852.53
ACD/LogD (pH 7.4): 6.62
ACD/BCF (pH 7.4): 49793.55
ACD/KOC (pH 7.4): 60531.97
Polar Surface Area: 33 Å2
Polarizability: 43.8±0.5 10-24cm3
Surface Tension: 44.3±7.0 dyne/cm
Molar Volume: 313.2±7.0 cm3

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