ChemSpider 2D Image | 2-Bromo-1-(3-methoxy-1-pyrrolidinyl)-1-butanone | C9H16BrNO2

2-Bromo-1-(3-methoxy-1-pyrrolidinyl)-1-butanone

  • Molecular FormulaC9H16BrNO2
  • Average mass250.133 Da
  • Monoisotopic mass249.036438 Da
  • ChemSpider ID34840540

More details:

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

1-Butanone, 2-bromo-1-(3-methoxy-1-pyrrolidinyl)- [ACD/Index Name]
2-Brom-1-(3-methoxy-1-pyrrolidinyl)-1-butanon [German] [ACD/IUPAC Name]
2-Bromo-1-(3-methoxy-1-pyrrolidinyl)-1-butanone [ACD/IUPAC Name]
2-Bromo-1-(3-méthoxy-1-pyrrolidinyl)-1-butanone [French] [ACD/IUPAC Name]

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

Density: 1.4±0.1 g/cm3
Boiling Point: 316.0±37.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.7 mmHg at 25°C
Enthalpy of Vaporization: 55.7±3.0 kJ/mol
Flash Point: 144.9±26.5 °C
Index of Refraction: 1.512
Molar Refractivity: 55.1±0.4 cm3
#H bond acceptors: 3
#H bond donors: 0
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: 0.81
ACD/LogD (pH 5.5): 1.03
ACD/BCF (pH 5.5): 3.56
ACD/KOC (pH 5.5): 86.45
ACD/LogD (pH 7.4): 1.03
ACD/BCF (pH 7.4): 3.56
ACD/KOC (pH 7.4): 86.45
Polar Surface Area: 30 Å2
Polarizability: 21.8±0.5 10-24cm3
Surface Tension: 40.0±5.0 dyne/cm
Molar Volume: 183.5±5.0 cm3

Click to predict properties on the Chemicalize site


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