ChemSpider 2D Image | 5,6,7-Trifluoro-1,2,3,4-tetrahydroisoquinoline | C9H8F3N

5,6,7-Trifluoro-1,2,3,4-tetrahydroisoquinoline

  • Molecular FormulaC9H8F3N
  • Average mass187.162 Da
  • Monoisotopic mass187.060883 Da
  • ChemSpider ID46159652

More details:

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

5,6,7-Trifluor-1,2,3,4-tetrahydroisochinolin [German] [ACD/IUPAC Name]
5,6,7-Trifluoro-1,2,3,4-tétrahydroisoquinoléine [French] [ACD/IUPAC Name]
5,6,7-Trifluoro-1,2,3,4-tetrahydroisoquinoline [ACD/IUPAC Name]
Isoquinoline, 5,6,7-trifluoro-1,2,3,4-tetrahydro- [ACD/Index Name]
1343194-21-7 [RN]
MFCD20306702

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

Density: 1.3±0.1 g/cm3
Boiling Point: 222.3±40.0 °C at 760 mmHg
Vapour Pressure: 0.1±0.4 mmHg at 25°C
Enthalpy of Vaporization: 45.9±3.0 kJ/mol
Flash Point: 88.2±27.3 °C
Index of Refraction: 1.488
Molar Refractivity: 41.8±0.3 cm3
#H bond acceptors: 1
#H bond donors: 1
#Freely Rotating Bonds: 0
#Rule of 5 Violations: 0
ACD/LogP: 1.42
ACD/LogD (pH 5.5): 0.04
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 3.32
ACD/LogD (pH 7.4): 1.64
ACD/BCF (pH 7.4): 8.62
ACD/KOC (pH 7.4): 131.56
Polar Surface Area: 12 Å2
Polarizability: 16.6±0.5 10-24cm3
Surface Tension: 33.1±3.0 dyne/cm
Molar Volume: 144.9±3.0 cm3

Click to predict properties on the Chemicalize site


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