ChemSpider 2D Image | (4R)-4-(3-Hydroxyphenyl)-2,7,7-trimethyl-3-(1-piperidinylcarbonyl)-4,6,7,8-tetrahydro-5(1H)-quinolinone | C24H30N2O3

(4R)-4-(3-Hydroxyphenyl)-2,7,7-trimethyl-3-(1-piperidinylcarbonyl)-4,6,7,8-tetrahydro-5(1H)-quinolinone

  • Molecular FormulaC24H30N2O3
  • Average mass394.507 Da
  • Monoisotopic mass394.225647 Da
  • ChemSpider ID62626193

  • defined stereocentres - 1 of 1 defined stereocentres

More details:

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

(4R)-4-(3-Hydroxyphenyl)-2,7,7-trimethyl-3-(1-piperidinylcarbonyl)-4,6,7,8-tetrahydro-5(1H)-chinolinon [German] [ACD/IUPAC Name]
(4R)-4-(3-Hydroxyphényl)-2,7,7-triméthyl-3-(1-pipéridinylcarbonyl)-4,6,7,8-tétrahydro-5(1H)-quinoléinone [French] [ACD/IUPAC Name]
(4R)-4-(3-Hydroxyphenyl)-2,7,7-trimethyl-3-(1-piperidinylcarbonyl)-4,6,7,8-tetrahydro-5(1H)-quinolinone [ACD/IUPAC Name]
5(1H)-Quinolinone, 4,6,7,8-tetrahydro-4-(3-hydroxyphenyl)-2,7,7-trimethyl-3-(1-piperidinylcarbonyl)-, (4R)- [ACD/Index Name]

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

Density: 1.2±0.1 g/cm3
Boiling Point: 618.7±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.9 mmHg at 25°C
Enthalpy of Vaporization: 95.1±3.0 kJ/mol
Flash Point: 328.0±31.5 °C
Index of Refraction: 1.620
Molar Refractivity: 112.2±0.4 cm3
#H bond acceptors: 5
#H bond donors: 2
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 0
ACD/LogP: 2.50
ACD/LogD (pH 5.5): 3.24
ACD/BCF (pH 5.5): 171.14
ACD/KOC (pH 5.5): 1381.08
ACD/LogD (pH 7.4): 3.24
ACD/BCF (pH 7.4): 170.28
ACD/KOC (pH 7.4): 1374.12
Polar Surface Area: 70 Å2
Polarizability: 44.5±0.5 10-24cm3
Surface Tension: 55.3±5.0 dyne/cm
Molar Volume: 319.4±5.0 cm3

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