ChemSpider 2D Image | 1-(4-Chloro-2-methylphenyl)-N-{[2-(1H-imidazol-1-yl)-3-pyridinyl]methyl}methanamine | C17H17ClN4

1-(4-Chloro-2-methylphenyl)-N-{[2-(1H-imidazol-1-yl)-3-pyridinyl]methyl}methanamine

  • Molecular FormulaC17H17ClN4
  • Average mass312.797 Da
  • Monoisotopic mass312.114166 Da
  • ChemSpider ID35178337

More details:






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

1-(4-Chlor-2-methylphenyl)-N-{[2-(1H-imidazol-1-yl)-3-pyridinyl]methyl}methanamin [German] [ACD/IUPAC Name]
1-(4-Chloro-2-methylphenyl)-N-{[2-(1H-imidazol-1-yl)-3-pyridinyl]methyl}methanamine [ACD/IUPAC Name]
1-(4-Chloro-2-méthylphényl)-N-{[2-(1H-imidazol-1-yl)-3-pyridinyl]méthyl}méthanamine [French] [ACD/IUPAC Name]
3-Pyridinemethanamine, N-[(4-chloro-2-methylphenyl)methyl]-2-(1H-imidazol-1-yl)- [ACD/Index Name]
[(4-CHLORO-2-METHYLPHENYL)METHYL]({[2-(1H-IMIDAZOL-1-YL)PYRIDIN-3-YL]METHYL})AMINE
[(4-CHLORO-2-METHYLPHENYL)METHYL]({[2-(IMIDAZOL-1-YL)PYRIDIN-3-YL]METHYL})AMINE

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

Density: 1.2±0.1 g/cm3
Boiling Point: 510.0±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.3 mmHg at 25°C
Enthalpy of Vaporization: 78.1±3.0 kJ/mol
Flash Point: 262.3±30.1 °C
Index of Refraction: 1.633
Molar Refractivity: 90.8±0.5 cm3
#H bond acceptors: 4
#H bond donors: 1
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 0
ACD/LogP: 2.74
ACD/LogD (pH 5.5): 1.38
ACD/BCF (pH 5.5): 2.68
ACD/KOC (pH 5.5): 24.17
ACD/LogD (pH 7.4): 2.83
ACD/BCF (pH 7.4): 75.21
ACD/KOC (pH 7.4): 678.14
Polar Surface Area: 43 Å2
Polarizability: 36.0±0.5 10-24cm3
Surface Tension: 45.8±7.0 dyne/cm
Molar Volume: 254.1±7.0 cm3

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