ChemSpider 2D Image | 2-(5-Bromo-8-fluoro-3,4-dihydro-2(1H)-isoquinolinyl)acetamide | C11H12BrFN2O

2-(5-Bromo-8-fluoro-3,4-dihydro-2(1H)-isoquinolinyl)acetamide

  • Molecular FormulaC11H12BrFN2O
  • Average mass287.128 Da
  • Monoisotopic mass286.011688 Da
  • ChemSpider ID35174709

More details:

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

2(1H)-Isoquinolineacetamide, 5-bromo-8-fluoro-3,4-dihydro- [ACD/Index Name]
2-(5-Brom-8-fluor-3,4-dihydro-2(1H)-isochinolinyl)acetamid [German] [ACD/IUPAC Name]
2-(5-Bromo-8-fluoro-3,4-dihydro-2(1H)-isoquinoléinyl)acétamide [French] [ACD/IUPAC Name]
2-(5-Bromo-8-fluoro-3,4-dihydro-2(1H)-isoquinolinyl)acetamide [ACD/IUPAC Name]
1607261-54-0 [RN]

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

Density: 1.5±0.1 g/cm3
Boiling Point: 420.1±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.0 mmHg at 25°C
Enthalpy of Vaporization: 67.4±3.0 kJ/mol
Flash Point: 207.9±28.7 °C
Index of Refraction: 1.587
Molar Refractivity: 62.6±0.3 cm3
#H bond acceptors: 3
#H bond donors: 2
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 0
ACD/LogP: 1.67
ACD/LogD (pH 5.5): 1.78
ACD/BCF (pH 5.5): 12.64
ACD/KOC (pH 5.5): 202.02
ACD/LogD (pH 7.4): 1.87
ACD/BCF (pH 7.4): 15.40
ACD/KOC (pH 7.4): 246.26
Polar Surface Area: 46 Å2
Polarizability: 24.8±0.5 10-24cm3
Surface Tension: 49.0±3.0 dyne/cm
Molar Volume: 186.1±3.0 cm3

Click to predict properties on the Chemicalize site


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