Chemical Properties of Butanoic acid, decyl ester (CAS 5454-09-1)

Butanoic acid, decyl ester

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InChI
InChI=1S/C14H28O2/c1-3-5-6-7-8-9-10-11-13-16-14(15)12-4-2/h3-13H2,1-2H3
InChI Key
PUCQHFICPFUPKW-UHFFFAOYSA-N
Formula
C14H28O2
SMILES
CCCCCCCCCCOC(=O)CCC
Molecular Weight1
228.37
CAS
5454-09-1
Other Names
  • Butyric acid, decyl ester
  • Decyl butanoate
  • Decyl butyrate
  • ENT 30734
  • n-Decyl butanoate
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Physical Properties

Property Value Unit Source
Δf -166.92 kJ/mol Joback Calculated Property
Δfgas -577.09 kJ/mol Joback Calculated Property
Δfus 34.80 kJ/mol Joback Calculated Property
Δvap 55.91 kJ/mol Joback Calculated Property
log10WS -4.55 Crippen Calculated Property
logPoct/wat 4.470 Crippen Calculated Property
McVol 215.560 ml/mol McGowan Calculated Property
Pc 1579.71 kPa Joback Calculated Property
Inp [1564.00; 1597.00]   Show Hide
Inp 1590.00 NIST
Inp 1566.00 NIST
Inp 1564.00 NIST
Inp 1565.00 NIST
Inp 1565.00 NIST
Inp 1571.00 NIST
Inp 1568.00 NIST
Inp Outlier 1597.00 NIST
Inp 1573.00 NIST
I [1807.00; 1830.00]   Show Hide
I 1822.00 NIST
I 1830.00 NIST
I 1807.00 NIST
Tboil [543.00; 543.00] K Show Hide
Tboil 543.00 ± 3.00 K NIST
Tboil 543.00 ± 6.00 K NIST
Tc 764.02 K Joback Calculated Property
Tfus 319.70 K Joback Calculated Property
Vc 0.844 m3/kmol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas [567.02; 658.29] J/mol×K [596.01; 764.02] Show Hide
Cp,gas 567.02 J/mol×K 596.01 Joback Calculated Property
Cp,gas 583.90 J/mol×K 624.01 Joback Calculated Property
Cp,gas 600.10 J/mol×K 652.01 Joback Calculated Property
Cp,gas 615.63 J/mol×K 680.02 Joback Calculated Property
Cp,gas 630.49 J/mol×K 708.02 Joback Calculated Property
Cp,gas 644.71 J/mol×K 736.02 Joback Calculated Property
Cp,gas 658.29 J/mol×K 764.02 Joback Calculated Property
η [0.0001532; 0.0027735] Pa×s [319.70; 596.01] Show Hide
η 0.0027735 Pa×s 319.70 Joback Calculated Property
η 0.0012632 Pa×s 365.75 Joback Calculated Property
η 0.0006860 Pa×s 411.80 Joback Calculated Property
η 0.0004212 Pa×s 457.86 Joback Calculated Property
η 0.0002827 Pa×s 503.91 Joback Calculated Property
η 0.0002029 Pa×s 549.96 Joback Calculated Property
η 0.0001532 Pa×s 596.01 Joback Calculated Property

Correlations

Property Value Unit Temperature (K) Source
Pvap [1.33; 202.63] kPa [421.12; 571.96] The Yaw... Show Hide
Equationln(Pvp) = A + B/(T + C)
Coefficient A1.61569e+01
Coefficient B-5.16764e+03
Coefficient C-9.54820e+01
Temperature range, min.421.12
Temperature range, max.571.96
Pvap 1.33 kPa 421.12 Calculated Property
Pvap 2.90 kPa 437.88 Calculated Property
Pvap 5.86 kPa 454.64 Calculated Property
Pvap 11.14 kPa 471.40 Calculated Property
Pvap 20.02 kPa 488.16 Calculated Property
Pvap 34.31 kPa 504.92 Calculated Property
Pvap 56.37 kPa 521.68 Calculated Property
Pvap 89.18 kPa 538.44 Calculated Property
Pvap 136.45 kPa 555.20 Calculated Property
Pvap 202.63 kPa 571.96 Calculated Property

Similar Compounds

Butanoic acid, undecyl ester. Butyric acid, hexadecyl ester. Eicosyl butyrate. Butyric acid, octadecyl ester. Butanoic acid, nonyl ester. Butyric acid, dodecyl ester. Butyric acid, tetradecyl ester. Butyric acid, pentadecyl ester. Butanoic acid, docosyl ester. Butanoic acid, octyl ester. Butyric acid, tridecyl ester. Butanoic acid, heptyl ester. hexyl-d3 butanoate-d3. Butanoic acid, hexyl ester. hexyl-d3 butanoate.

Find more compounds similar to Butanoic acid, decyl ester.

Sources

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Outlier This icon means that the value is more than 2 standard deviations away from the property mean.