ChemSpider 2D Image | 1-Methyl-4-(~2~H_5_)phenyl-1,2,3,6-tetrahydropyridine | C12H10D5N

1-Methyl-4-(2H5)phenyl-1,2,3,6-tetrahydropyridine

  • Molecular FormulaC12H10D5N
  • Average mass178.285 Da
  • Monoisotopic mass178.151840 Da
  • ChemSpider ID48062901
  • Non-standard isotope - Non-standard isotope


More details:






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

1-Methyl-4-(2H5)phenyl-1,2,3,6-tetrahydropyridin [German] [ACD/IUPAC Name]
1-Methyl-4-(2H5)phenyl-1,2,3,6-tetrahydropyridine [ACD/IUPAC Name]
1-Méthyl-4-(2H5)phényl-1,2,3,6-tétrahydropyridine [French] [ACD/IUPAC Name]
Pyridine, 1,2,3,6-tetrahydro-1-methyl-4-(phenyl-d5)- [ACD/Index Name]
1-methyl-4-(2,3,4,5,6-pentadeuteriophenyl)-3,6-dihydro-2H-pyridine
204689-33-8 [RN]

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

Density: 1.0±0.1 g/cm3
Boiling Point: 258.6±0.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.5 mmHg at 25°C
Enthalpy of Vaporization: 49.6±3.0 kJ/mol
Flash Point: 105.8±21.2 °C
Index of Refraction: 1.553
Molar Refractivity: 55.4±0.3 cm3
#H bond acceptors: 1
#H bond donors: 0
#Freely Rotating Bonds: 1
#Rule of 5 Violations: 0
ACD/LogP: 2.28
ACD/LogD (pH 5.5): -0.28
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): 1.27
ACD/BCF (pH 7.4): 2.69
ACD/KOC (pH 7.4): 30.55
Polar Surface Area: 3 Å2
Polarizability: 22.0±0.5 10-24cm3
Surface Tension: 36.3±3.0 dyne/cm
Molar Volume: 173.0±3.0 cm3

Click to predict properties on the Chemicalize site






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