ChemSpider 2D Image | 4-Bromo-1-(3,3-dimethoxy-1-pyrrolidinyl)-1-butanone | C10H18BrNO3

4-Bromo-1-(3,3-dimethoxy-1-pyrrolidinyl)-1-butanone

  • Molecular FormulaC10H18BrNO3
  • Average mass280.159 Da
  • Monoisotopic mass279.046997 Da
  • ChemSpider ID30774006

More details:






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

1-Butanone, 4-bromo-1-(3,3-dimethoxy-1-pyrrolidinyl)- [ACD/Index Name]
4-Brom-1-(3,3-dimethoxy-1-pyrrolidinyl)-1-butanon [German] [ACD/IUPAC Name]
4-Bromo-1-(3,3-dimethoxy-1-pyrrolidinyl)-1-butanone [ACD/IUPAC Name]
4-Bromo-1-(3,3-diméthoxy-1-pyrrolidinyl)-1-butanone [French] [ACD/IUPAC Name]

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module

Density: 1.4±0.1 g/cm3
Boiling Point: 354.8±42.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.8 mmHg at 25°C
Enthalpy of Vaporization: 60.0±3.0 kJ/mol
Flash Point: 168.4±27.9 °C
Index of Refraction: 1.511
Molar Refractivity: 61.5±0.4 cm3
#H bond acceptors: 4
#H bond donors: 0
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 0
ACD/LogP: 0.32
ACD/LogD (pH 5.5): 0.82
ACD/BCF (pH 5.5): 2.48
ACD/KOC (pH 5.5): 66.63
ACD/LogD (pH 7.4): 0.82
ACD/BCF (pH 7.4): 2.48
ACD/KOC (pH 7.4): 66.63
Polar Surface Area: 39 Å2
Polarizability: 24.4±0.5 10-24cm3
Surface Tension: 41.9±5.0 dyne/cm
Molar Volume: 205.3±5.0 cm3

Click to predict properties on the Chemicalize site






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