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DIBUTYL CARBONATE

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DIBUTYL CARBONATE Basic information

Product Name:
DIBUTYL CARBONATE
Synonyms:
  • DI-N-BUTYL CARBONATE
  • DIBUTYL CARBONATE
  • CARBON DIOXIDEDI-N-BUTYL ESTER
  • BUTYL CARBONATE
  • Carbonic acid, dibutyl ester
  • Carbonic acid, di-n-butyl ester
  • Carbonicacid,dibutylester
  • carbonicaciddibutylester
CAS:
542-52-9
MF:
C9H18O3
MW:
174.24
EINECS:
208-816-0
Product Categories:
  • Inhibitors
  • CARBONATES
Mol File:
542-52-9.mol
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DIBUTYL CARBONATE Chemical Properties

Melting point:
<25 °C
Boiling point:
bp 206.6°
Density 
d420 0.9251; d425 0.9388
refractive index 
nD20 1.4117
storage temp. 
2-8°C
form 
clear liquid
color 
Colorless to Almost colorless
EPA Substance Registry System
Carbonic acid, dibutyl ester (542-52-9)
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Safety Information

HS Code 
2920.90.5100
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DIBUTYL CARBONATE Usage And Synthesis

Chemical Properties

liquid

Uses

Dibutyl Carbonate is a potential fuel substitute due to the observed decrease in CO2 emissions. Also used in CO2 catalytic activation.

Preparation

A 160 mL Parr autoclave was charged with butanol 982 (2.22 g, 0.03 mol), N-cyclohexyl-N',N',N'',N''-tetramethylguanidine (CyTMG; 6.9 g, 0.035 mol), and acetonitrile (30 mL). The autoclave was attached to a pressure head, and 160 psig CO2 was introduced with stirring at room temperature. An exothermic reaction ensued, leading to an increase in temperature to ca. 40℃. In a Fischer–Porter bottle was placed a solution of 1-chlorobutane (8.33 g, 0.09 mol) in acetonitrile (10 mL). This bottle was attached to a pressure head, and 80 psig CO2 was introduced above the solution. After 1 h, the solution of 1-chlorobutane was added in one portion under 80 psig CO2 to the pre-formed carbonate anion solution generated in the autoclave. After the addition, the pressure was increased to 160 psig with CO2, and the reaction mixture was warmed to 85 ℃ for 16 h. Thereafter, the reaction mixture was allowed to cool to room temperature, and then the pressure was released. An aliquot was removed, diluted with diethyl ether, and CyTMGH+Cl- was filtered off; by GC analysis using biphenyl as an internal standard, the yield of dibutyl carbonate was calculated as 73%; oil.

Flammability and Explosibility

Not classified

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