ChemSpider 2D Image | 3-Bromo-1-methylisoquinoline | C10H8BrN

3-Bromo-1-methylisoquinoline

  • Molecular FormulaC10H8BrN
  • Average mass222.081 Da
  • Monoisotopic mass220.984009 Da
  • ChemSpider ID29737705

More details:

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

1041263-08-4 [RN]
3-Brom-1-methylisochinolin [German] [ACD/IUPAC Name]
3-Bromo-1-méthylisoquinoléine [French] [ACD/IUPAC Name]
3-Bromo-1-methylisoquinoline [ACD/IUPAC Name]
Isoquinoline, 3-bromo-1-methyl- [ACD/Index Name]
3-BROMO-1-METHYLISOQUINOLINE|3-BROMO-1-METHYLISOQUINOLINE
MFCD27922674

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

Density: 1.5±0.1 g/cm3
Boiling Point: 320.1±22.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.7 mmHg at 25°C
Enthalpy of Vaporization: 53.9±3.0 kJ/mol
Flash Point: 147.4±22.3 °C
Index of Refraction: 1.654
Molar Refractivity: 54.7±0.3 cm3
#H bond acceptors: 1
#H bond donors: 0
#Freely Rotating Bonds: 0
#Rule of 5 Violations: 0
ACD/LogP: 3.22
ACD/LogD (pH 5.5): 3.24
ACD/BCF (pH 5.5): 170.69
ACD/KOC (pH 5.5): 1377.95
ACD/LogD (pH 7.4): 3.24
ACD/BCF (pH 7.4): 170.94
ACD/KOC (pH 7.4): 1379.96
Polar Surface Area: 13 Å2
Polarizability: 21.7±0.5 10-24cm3
Surface Tension: 48.3±3.0 dyne/cm
Molar Volume: 149.2±3.0 cm3

Click to predict properties on the Chemicalize site


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