ChemSpider 2D Image | 1-(4-Bromobenzyl)-2-methyl-1,2,3,4-tetrahydroquinoline | C17H18BrN

1-(4-Bromobenzyl)-2-methyl-1,2,3,4-tetrahydroquinoline

  • Molecular FormulaC17H18BrN
  • Average mass316.236 Da
  • Monoisotopic mass315.062256 Da
  • ChemSpider ID34455299

More details:






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

1-(4-Brombenzyl)-2-methyl-1,2,3,4-tetrahydrochinolin [German] [ACD/IUPAC Name]
1-(4-Bromobenzyl)-2-méthyl-1,2,3,4-tétrahydroquinoléine [French] [ACD/IUPAC Name]
1-(4-Bromobenzyl)-2-methyl-1,2,3,4-tetrahydroquinoline [ACD/IUPAC Name]
Quinoline, 1-[(4-bromophenyl)methyl]-1,2,3,4-tetrahydro-2-methyl- [ACD/Index Name]
1-[(4-bromophenyl)methyl]-2-methyl-1,2,3,4-tetrahydroquinoline

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

Density: 1.3±0.1 g/cm3
Boiling Point: 432.7±33.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.0 mmHg at 25°C
Enthalpy of Vaporization: 68.9±3.0 kJ/mol
Flash Point: 215.5±25.4 °C
Index of Refraction: 1.608
Molar Refractivity: 83.6±0.3 cm3
#H bond acceptors: 1
#H bond donors: 0
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 1
ACD/LogP: 5.60
ACD/LogD (pH 5.5): 5.07
ACD/BCF (pH 5.5): 3792.84
ACD/KOC (pH 5.5): 11223.60
ACD/LogD (pH 7.4): 5.26
ACD/BCF (pH 7.4): 5800.96
ACD/KOC (pH 7.4): 17165.95
Polar Surface Area: 3 Å2
Polarizability: 33.1±0.5 10-24cm3
Surface Tension: 43.7±3.0 dyne/cm
Molar Volume: 241.8±3.0 cm3

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