ChemSpider 2D Image | (3-Ethyl-2-methyl-6-quinolinyl)(cis-4-methoxycyclohexyl)methanone | C20H25NO2

(3-Ethyl-2-methyl-6-quinolinyl)(cis-4-methoxycyclohexyl)methanone

  • Molecular FormulaC20H25NO2
  • Average mass311.418 Da
  • Monoisotopic mass311.188538 Da
  • ChemSpider ID23257350

  • defined stereocentres - 2 of 2 defined stereocentres

More details:

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

(3-Ethyl-2-methyl-6-chinolinyl)(cis-4-methoxycyclohexyl)methanon [German] [ACD/IUPAC Name]
(3-Éthyl-2-méthyl-6-quinoléinyl)(cis-4-méthoxycyclohexyl)méthanone [French] [ACD/IUPAC Name]
(3-Ethyl-2-methyl-6-quinolinyl)(cis-4-methoxycyclohexyl)methanone [ACD/IUPAC Name]
(3-ethyl-2-methylquinolin-6-yl)(cis-4-methoxycyclohexyl)methanone
Methanone, (3-ethyl-2-methyl-6-quinolinyl)(cis-4-methoxycyclohexyl)- [ACD/Index Name]
(3-ethyl-2-methylquinolin-6-yl)-(4-methoxycyclohexyl)methanone
(3-Ethyl-2-methyl-quinolin-6-yl)-(4-methoxy-cyclohexyl)-methanone
CHEMBL188906
JNJ-16567083

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

Density: 1.1±0.1 g/cm3
Boiling Point: 451.9±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.1 mmHg at 25°C
Enthalpy of Vaporization: 71.1±3.0 kJ/mol
Flash Point: 227.1±28.7 °C
Index of Refraction: 1.574
Molar Refractivity: 92.8±0.4 cm3
#H bond acceptors: 3
#H bond donors: 0
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: 3.99
ACD/LogD (pH 5.5): 4.21
ACD/BCF (pH 5.5): 877.01
ACD/KOC (pH 5.5): 4100.58
ACD/LogD (pH 7.4): 4.34
ACD/BCF (pH 7.4): 1163.04
ACD/KOC (pH 7.4): 5437.96
Polar Surface Area: 39 Å2
Polarizability: 36.8±0.5 10-24cm3
Surface Tension: 46.1±5.0 dyne/cm
Molar Volume: 281.4±5.0 cm3

Click to predict properties on the Chemicalize site


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