ChemSpider 2D Image | Methyl 4-[(chlorocarbonyl)oxy]butanoate | C6H9ClO4

Methyl 4-[(chlorocarbonyl)oxy]butanoate

  • Molecular FormulaC6H9ClO4
  • Average mass180.586 Da
  • Monoisotopic mass180.018936 Da
  • ChemSpider ID62931195

More details:

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

4-[(Chlorocarbonyl)oxy]butanoate de méthyle [French] [ACD/IUPAC Name]
Butanoic acid, 4-[(chlorocarbonyl)oxy]-, methyl ester [ACD/Index Name]
Methyl 4-[(chlorocarbonyl)oxy]butanoate [ACD/IUPAC Name]
Methyl-4-[(chlorcarbonyl)oxy]butanoat [German] [ACD/IUPAC Name]
943592-23-2 [RN]

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

Density: 1.2±0.1 g/cm3
Boiling Point: 219.8±23.0 °C at 760 mmHg
Vapour Pressure: 0.1±0.4 mmHg at 25°C
Enthalpy of Vaporization: 45.6±3.0 kJ/mol
Flash Point: 89.7±21.6 °C
Index of Refraction: 1.437
Molar Refractivity: 38.2±0.3 cm3
#H bond acceptors: 4
#H bond donors: 0
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 0
ACD/LogP: 1.39
ACD/LogD (pH 5.5): 1.44
ACD/BCF (pH 5.5): 7.28
ACD/KOC (pH 5.5): 144.06
ACD/LogD (pH 7.4): 1.44
ACD/BCF (pH 7.4): 7.28
ACD/KOC (pH 7.4): 144.06
Polar Surface Area: 53 Å2
Polarizability: 15.2±0.5 10-24cm3
Surface Tension: 36.5±3.0 dyne/cm
Molar Volume: 145.9±3.0 cm3

Click to predict properties on the Chemicalize site


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