ChemSpider 2D Image | (4aR,8aR)-3,3-Dimethyloctahydro-2(1H)-quinoxalinone | C10H18N2O

(4aR,8aR)-3,3-Dimethyloctahydro-2(1H)-quinoxalinone

  • Molecular FormulaC10H18N2O
  • Average mass182.263 Da
  • Monoisotopic mass182.141907 Da
  • ChemSpider ID32801125

  • defined stereocentres - 2 of 2 defined stereocentres

More details:

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

(4aR,8aR)-3,3-Dimethyloctahydro-2(1H)-chinoxalinon [German] [ACD/IUPAC Name]
(4aR,8aR)-3,3-Dimethyloctahydro-2(1H)-quinoxalinone [ACD/IUPAC Name]
(4aR,8aR)-3,3-Diméthyloctahydro-2(1H)-quinoxalinone [French] [ACD/IUPAC Name]
2(1H)-Quinoxalinone, octahydro-3,3-dimethyl-, (4aR,8aR)- [ACD/Index Name]
(4aR,8aR)-3,3-Dimethyloctahydroquinoxalin-2(1H)-one
71029-04-4 [RN]

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

Density: 1.0±0.1 g/cm3
Boiling Point: 341.6±35.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.7 mmHg at 25°C
Enthalpy of Vaporization: 58.5±3.0 kJ/mol
Flash Point: 145.3±26.1 °C
Index of Refraction: 1.463
Molar Refractivity: 51.1±0.3 cm3
#H bond acceptors: 3
#H bond donors: 2
#Freely Rotating Bonds: 0
#Rule of 5 Violations: 0
ACD/LogP: 0.39
ACD/LogD (pH 5.5): -1.20
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): 0.38
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 27.87
Polar Surface Area: 41 Å2
Polarizability: 20.3±0.5 10-24cm3
Surface Tension: 27.7±3.0 dyne/cm
Molar Volume: 185.4±3.0 cm3

Click to predict properties on the Chemicalize site


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