ChemSpider 2D Image | 1-(2-Bromo-3,6-dimethoxyphenyl)-2-propanamine | C11H16BrNO2

1-(2-Bromo-3,6-dimethoxyphenyl)-2-propanamine

  • Molecular FormulaC11H16BrNO2
  • Average mass274.154 Da
  • Monoisotopic mass273.036438 Da
  • ChemSpider ID76442859

More details:






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

1-(2-Brom-3,6-dimethoxyphenyl)-2-propanamin [German] [ACD/IUPAC Name]
1-(2-Bromo-3,6-dimethoxyphenyl)-2-propanamine [ACD/IUPAC Name]
1-(2-Bromo-3,6-diméthoxyphényl)-2-propanamine [French] [ACD/IUPAC Name]
Benzeneethanamine, 2-bromo-3,6-dimethoxy-α-methyl- [ACD/Index Name]

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

Density: 1.3±0.1 g/cm3
Boiling Point: 336.9±37.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.7 mmHg at 25°C
Enthalpy of Vaporization: 58.0±3.0 kJ/mol
Flash Point: 157.5±26.5 °C
Index of Refraction: 1.540
Molar Refractivity: 65.0±0.3 cm3
#H bond acceptors: 3
#H bond donors: 2
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: 2.38
ACD/LogD (pH 5.5): -0.66
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): 0.42
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 5.13
Polar Surface Area: 44 Å2
Polarizability: 25.8±0.5 10-24cm3
Surface Tension: 38.0±3.0 dyne/cm
Molar Volume: 207.0±3.0 cm3

Click to predict properties on the Chemicalize site






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