ChemSpider 2D Image | 2-Bromo-1-[(2R,6S)-2,6-dimethyl-4-morpholinyl]-1-propanone | C9H16BrNO2

2-Bromo-1-[(2R,6S)-2,6-dimethyl-4-morpholinyl]-1-propanone

  • Molecular FormulaC9H16BrNO2
  • Average mass250.133 Da
  • Monoisotopic mass249.036438 Da
  • ChemSpider ID27455880

  • defined stereocentres - 2 of 3 defined stereocentres

More details:

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

1-Propanone, 2-bromo-1-[(2R,6S)-2,6-dimethyl-4-morpholinyl]- [ACD/Index Name]
2-Brom-1-[(2R,6S)-2,6-dimethyl-4-morpholinyl]-1-propanon [German] [ACD/IUPAC Name]
2-Bromo-1-[(2R,6S)-2,6-dimethyl-4-morpholinyl]-1-propanone [ACD/IUPAC Name]
2-Bromo-1-[(2R,6S)-2,6-diméthyl-4-morpholinyl]-1-propanone [French] [ACD/IUPAC Name]
(2R,6S)-4-(2-bromopropanoyl)-2,6-dimethylmorpholine
1290628-07-7 [RN]
MFCD15731870

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

Density: 1.3±0.1 g/cm3
Boiling Point: 320.0±37.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.7 mmHg at 25°C
Enthalpy of Vaporization: 56.2±3.0 kJ/mol
Flash Point: 147.3±26.5 °C
Index of Refraction: 1.487
Molar Refractivity: 54.6±0.3 cm3
#H bond acceptors: 3
#H bond donors: 0
#Freely Rotating Bonds: 1
#Rule of 5 Violations: 0
ACD/LogP: 1.71
ACD/LogD (pH 5.5): 1.38
ACD/BCF (pH 5.5): 6.62
ACD/KOC (pH 5.5): 134.71
ACD/LogD (pH 7.4): 1.38
ACD/BCF (pH 7.4): 6.62
ACD/KOC (pH 7.4): 134.71
Polar Surface Area: 30 Å2
Polarizability: 21.6±0.5 10-24cm3
Surface Tension: 34.3±3.0 dyne/cm
Molar Volume: 189.9±3.0 cm3

Click to predict properties on the Chemicalize site


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