Chemical Properties of n-Butyl cyanoacetate (CAS 5459-58-5)

n-Butyl cyanoacetate

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InChI
InChI=1S/C7H11NO2/c1-2-3-6-10-7(9)4-5-8/h2-4,6H2,1H3
InChI Key
DJACTCNGCHPGOI-UHFFFAOYSA-N
Formula
C7H11NO2
SMILES
CCCCOC(=O)CC#N
Molecular Weight1
141.17
CAS
5459-58-5
Other Names
  • Butyl cyanoacetate
  • Cyanoacetic acid n-butyl ester
  • Acetic acid, cyano-, butyl ester
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Physical Properties

Property Value Unit Source
Δf -92.68 kJ/mol Joback Calculated Property
Δfgas -267.73 kJ/mol Joback Calculated Property
Δfus 18.18 kJ/mol Joback Calculated Property
Δvap 50.81 kJ/mol Joback Calculated Property
log10WS -1.48 Crippen Calculated Property
logPoct/wat 1.243 Crippen Calculated Property
McVol 118.310 ml/mol McGowan Calculated Property
Pc 2862.74 kPa Joback Calculated Property
Tboil 537.93 K Joback Calculated Property
Tc 733.24 K Joback Calculated Property
Tfus 305.80 K Joback Calculated Property
Vc 0.477 m3/kmol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas [265.53; 317.35] J/mol×K [537.93; 733.24] Show Hide
Cp,gas 265.53 J/mol×K 537.93 Joback Calculated Property
Cp,gas 275.19 J/mol×K 570.48 Joback Calculated Property
Cp,gas 284.44 J/mol×K 603.03 Joback Calculated Property
Cp,gas 293.28 J/mol×K 635.59 Joback Calculated Property
Cp,gas 301.71 J/mol×K 668.14 Joback Calculated Property
Cp,gas 309.73 J/mol×K 700.69 Joback Calculated Property
Cp,gas 317.35 J/mol×K 733.24 Joback Calculated Property

Pressure Dependent Properties

Property Value Unit Pressure (kPa) Source
Tboilr 388.20 K 2.00 NIST

Similar Compounds

Propanoic acid, butyl ester. Acetic acid, butyl ester. butyl-d3 acetate. 1,4-Butanediol, dipropionate. Cyanoacetic acid, hexyl ester. butyl-d3 butanoate-d3. butyl-d3 butanoate. Butanoic acid, butyl ester. butyl butanoate-d3. Propanedioic acid, dibutyl ester. Cyanoacetic acid, heptyl ester. Butyl glyoxylate. Cyanoacetic acid, undecyl ester. Cyanoacetic acid, octadecyl ester. Cyanoacetic acid, nonyl ester.

Find more compounds similar to n-Butyl cyanoacetate.

Sources

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