Found 170 results

Search term: MF = 'C_{17}H_{14}Br_{2}N_{2}'
ChemSpider 2D Image | N-[(1R)-1-(2,4-Dibromophenyl)ethyl]-5-isoquinolinamine | C17H14Br2N2

N-[(1R)-1-(2,4-Dibromophenyl)ethyl]-5-isoquinolinamine

  • Molecular FormulaC17H14Br2N2
  • Average mass406.115 Da
  • Monoisotopic mass403.952362 Da
  • ChemSpider ID62670131

  • defined stereocentres - 1 of 1 defined stereocentres

More details:

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

5-Isoquinolinamine, N-[(1R)-1-(2,4-dibromophenyl)ethyl]- [ACD/Index Name]
N-[(1R)-1-(2,4-Dibromophényl)éthyl]-5-isoquinoléinamine [French] [ACD/IUPAC Name]
N-[(1R)-1-(2,4-Dibromophenyl)ethyl]-5-isoquinolinamine [ACD/IUPAC Name]
N-[(1R)-1-(2,4-Dibromphenyl)ethyl]-5-isochinolinamin [German] [ACD/IUPAC Name]

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

Density: 1.6±0.1 g/cm3
Boiling Point: 515.2±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.3 mmHg at 25°C
Enthalpy of Vaporization: 78.7±3.0 kJ/mol
Flash Point: 265.4±28.7 °C
Index of Refraction: 1.710
Molar Refractivity: 96.3±0.3 cm3
#H bond acceptors: 2
#H bond donors: 1
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: 4.71
ACD/LogD (pH 5.5): 4.99
ACD/BCF (pH 5.5): 2933.55
ACD/KOC (pH 5.5): 8191.33
ACD/LogD (pH 7.4): 5.37
ACD/BCF (pH 7.4): 7035.40
ACD/KOC (pH 7.4): 19644.91
Polar Surface Area: 25 Å2
Polarizability: 38.2±0.5 10-24cm3
Surface Tension: 56.4±3.0 dyne/cm
Molar Volume: 246.6±3.0 cm3

Click to predict properties on the Chemicalize site


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