ChemSpider 2D Image | 8-Bromo-3-chloro-5-nitroisoquinoline | C9H4BrClN2O2

8-Bromo-3-chloro-5-nitroisoquinoline

  • Molecular FormulaC9H4BrClN2O2
  • Average mass287.497 Da
  • Monoisotopic mass285.914459 Da
  • ChemSpider ID92171025

More details:

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

8-Brom-3-chlor-5-nitroisochinolin [German] [ACD/IUPAC Name]
8-Bromo-3-chloro-5-nitroisoquinoléine [French] [ACD/IUPAC Name]
8-Bromo-3-chloro-5-nitroisoquinoline [ACD/IUPAC Name]
Isoquinoline, 8-bromo-3-chloro-5-nitro- [ACD/Index Name]

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

Density: 1.8±0.1 g/cm3
Boiling Point: 420.7±40.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.0 mmHg at 25°C
Enthalpy of Vaporization: 64.8±3.0 kJ/mol
Flash Point: 208.2±27.3 °C
Index of Refraction: 1.711
Molar Refractivity: 61.3±0.3 cm3
#H bond acceptors: 4
#H bond donors: 0
#Freely Rotating Bonds: 1
#Rule of 5 Violations: 0
ACD/LogP: 2.96
ACD/LogD (pH 5.5): 3.28
ACD/BCF (pH 5.5): 183.66
ACD/KOC (pH 5.5): 1452.75
ACD/LogD (pH 7.4): 3.28
ACD/BCF (pH 7.4): 183.66
ACD/KOC (pH 7.4): 1452.75
Polar Surface Area: 59 Å2
Polarizability: 24.3±0.5 10-24cm3
Surface Tension: 66.2±3.0 dyne/cm
Molar Volume: 156.8±3.0 cm3

Click to predict properties on the Chemicalize site


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