ChemSpider 2D Image | 2-(Trifluoroacetyl)-1,2,3,4-Tetrahydroisoquinolin-7-Ol | C11H10F3NO2

2-(Trifluoroacetyl)-1,2,3,4-Tetrahydroisoquinolin-7-Ol

  • Molecular FormulaC11H10F3NO2
  • Average mass245.198 Da
  • Monoisotopic mass245.066360 Da
  • ChemSpider ID26329316

More details:

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

2-(Trifluoroacetyl)-1,2,3,4-Tetrahydroisoquinolin-7-Ol
2,2,2-Trifluor-1-(7-hydroxy-3,4-dihydro-2(1H)-isochinolinyl)ethanon [German] [ACD/IUPAC Name]
2,2,2-Trifluoro-1-(7-hydroxy-3,4-dihydro-2(1H)-isoquinoléinyl)éthanone [French] [ACD/IUPAC Name]
2,2,2-Trifluoro-1-(7-hydroxy-3,4-dihydro-2(1H)-isoquinolinyl)ethanone [ACD/IUPAC Name]
Ethanone, 1-(3,4-dihydro-7-hydroxy-2(1H)-isoquinolinyl)-2,2,2-trifluoro- [ACD/Index Name]
1281902-37-1 [RN]
MFCD20148544
W14

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

Density: 1.4±0.1 g/cm3
Boiling Point: 425.1±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.0 mmHg at 25°C
Enthalpy of Vaporization: 70.6±3.0 kJ/mol
Flash Point: 210.9±28.7 °C
Index of Refraction: 1.530
Molar Refractivity: 53.5±0.3 cm3
#H bond acceptors: 3
#H bond donors: 1
#Freely Rotating Bonds: 1
#Rule of 5 Violations: 0
ACD/LogP: 2.51
ACD/LogD (pH 5.5): 2.35
ACD/BCF (pH 5.5): 35.94
ACD/KOC (pH 5.5): 452.00
ACD/LogD (pH 7.4): 2.35
ACD/BCF (pH 7.4): 35.82
ACD/KOC (pH 7.4): 450.47
Polar Surface Area: 41 Å2
Polarizability: 21.2±0.5 10-24cm3
Surface Tension: 42.6±3.0 dyne/cm
Molar Volume: 173.4±3.0 cm3

Click to predict properties on the Chemicalize site


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