ChemSpider 2D Image | (2-Bromo-6-fluorophenyl)[(3S)-3-hydroxy-1-pyrrolidinyl]methanone | C11H11BrFNO2

(2-Bromo-6-fluorophenyl)[(3S)-3-hydroxy-1-pyrrolidinyl]methanone

  • Molecular FormulaC11H11BrFNO2
  • Average mass288.113 Da
  • Monoisotopic mass286.995697 Da
  • ChemSpider ID30440630

  • defined stereocentres - 1 of 1 defined stereocentres

More details:

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

(2-Brom-6-fluorphenyl)[(3S)-3-hydroxy-1-pyrrolidinyl]methanon [German] [ACD/IUPAC Name]
(2-Bromo-6-fluorophenyl)[(3S)-3-hydroxy-1-pyrrolidinyl]methanone [ACD/IUPAC Name]
(2-Bromo-6-fluorophényl)[(3S)-3-hydroxy-1-pyrrolidinyl]méthanone [French] [ACD/IUPAC Name]
Methanone, (2-bromo-6-fluorophenyl)[(3S)-3-hydroxy-1-pyrrolidinyl]- [ACD/Index Name]

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

Density: 1.7±0.1 g/cm3
Boiling Point: 430.4±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.1 mmHg at 25°C
Enthalpy of Vaporization: 72.3±3.0 kJ/mol
Flash Point: 214.1±28.7 °C
Index of Refraction: 1.617
Molar Refractivity: 60.9±0.3 cm3
#H bond acceptors: 3
#H bond donors: 1
#Freely Rotating Bonds: 1
#Rule of 5 Violations: 0
ACD/LogP: -0.73
ACD/LogD (pH 5.5): 0.75
ACD/BCF (pH 5.5): 2.19
ACD/KOC (pH 5.5): 61.09
ACD/LogD (pH 7.4): 0.75
ACD/BCF (pH 7.4): 2.19
ACD/KOC (pH 7.4): 61.09
Polar Surface Area: 41 Å2
Polarizability: 24.2±0.5 10-24cm3
Surface Tension: 57.4±3.0 dyne/cm
Molar Volume: 174.2±3.0 cm3

Click to predict properties on the Chemicalize site


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