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Search term: LOVUSVPDJMJWAS-NOZJJQNGSA-N (Found by InChIKey (full match))
ChemSpider 2D Image | (7R,8R)-7,8-Diethyl-4-(trifluoromethyl)-6,7,8,9-tetrahydropyrido[3,2-g]quinolin-2(1H)-one | C17H19F3N2O

(7R,8R)-7,8-Diethyl-4-(trifluoromethyl)-6,7,8,9-tetrahydropyrido[3,2-g]quinolin-2(1H)-one

  • Molecular FormulaC17H19F3N2O
  • Average mass324.341 Da
  • Monoisotopic mass324.144958 Da
  • ChemSpider ID23107685

  • defined stereocentres - 2 of 2 defined stereocentres

More details:

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

(7R,8R)-7,8-Diethyl-4-(trifluormethyl)-6,7,8,9-tetrahydropyrido[3,2-g]chinolin-2(1H)-on [German] [ACD/IUPAC Name]
(7R,8R)-7,8-Diéthyl-4-(trifluorométhyl)-6,7,8,9-tétrahydropyrido[3,2-g]quinoléin-2(1H)-one [French] [ACD/IUPAC Name]
(7R,8R)-7,8-Diethyl-4-(trifluoromethyl)-6,7,8,9-tetrahydropyrido[3,2-g]quinolin-2(1H)-one [ACD/IUPAC Name]
Pyrido[3,2-g]quinolin-2(1H)-one, 7,8-diethyl-6,7,8,9-tetrahydro-4-(trifluoromethyl)-, (7R,8R)- [ACD/Index Name]
(7R,8R)-7,8-Diethyl-4-trifluoromethyl-6,7,8,9-tetrahydro-1H-pyrido[3,2-g]quinolin-2-one
CHEMBL7421

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

Density: 1.2±0.1 g/cm3
Boiling Point: 497.0±40.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.3 mmHg at 25°C
Enthalpy of Vaporization: 79.4±3.0 kJ/mol
Flash Point: 254.4±27.3 °C
Index of Refraction: 1.536
Molar Refractivity: 83.2±0.3 cm3
#H bond acceptors: 3
#H bond donors: 2
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 1
ACD/LogP: 6.01
ACD/LogD (pH 5.5): 2.80
ACD/BCF (pH 5.5): 24.37
ACD/KOC (pH 5.5): 84.27
ACD/LogD (pH 7.4): 2.79
ACD/BCF (pH 7.4): 23.37
ACD/KOC (pH 7.4): 80.82
Polar Surface Area: 45 Å2
Polarizability: 33.0±0.5 10-24cm3
Surface Tension: 38.6±3.0 dyne/cm
Molar Volume: 266.7±3.0 cm3

Click to predict properties on the Chemicalize site


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