Chemical Properties of Propanoic acid, 2-methyl-, heptyl ester (CAS 2349-13-5)

Propanoic acid, 2-methyl-, heptyl ester

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InChI
InChI=1S/C11H22O2/c1-4-5-6-7-8-9-13-11(12)10(2)3/h10H,4-9H2,1-3H3
InChI Key
RFDUMBPGZUIKOG-UHFFFAOYSA-N
Formula
C11H22O2
SMILES
CCCCCCCOC(=O)C(C)C
Molecular Weight1
186.29
CAS
2349-13-5
Other Names
  • ENT 21506
  • HeptyI isobutyrate
  • Heptyl isobutanoate
  • Heptyl isobutyrate
  • Isobutyric acid, heptyl ester
  • n-Heptyl iso-butyrate
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Physical Properties

Property Value Unit Source
Δf -194.62 kJ/mol Joback Calculated Property
Δfgas -520.45 kJ/mol Joback Calculated Property
Δfus 23.51 kJ/mol Joback Calculated Property
Δvap 48.85 kJ/mol Joback Calculated Property
log10WS -3.05 Crippen Calculated Property
logPoct/wat 3.156 Crippen Calculated Property
McVol 173.290 ml/mol McGowan Calculated Property
Pc 2029.06 kPa Joback Calculated Property
Inp [1233.00; 1248.00]   Show Hide
Inp 1248.00 NIST
Inp 1233.00 NIST
Inp 1233.00 NIST
Inp 1248.00 NIST
Inp 1233.00 NIST
I [1433.00; 1449.00]   Show Hide
I 1449.00 NIST
I 1433.00 NIST
Tboil 526.93 K Joback Calculated Property
Tc 701.19 K Joback Calculated Property
Tfus 270.89 K Joback Calculated Property
Vc 0.669 m3/kmol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas [415.48; 498.48] J/mol×K [526.93; 701.19] Show Hide
Cp,gas 415.48 J/mol×K 526.93 Joback Calculated Property
Cp,gas 430.78 J/mol×K 555.97 Joback Calculated Property
Cp,gas 445.49 J/mol×K 585.02 Joback Calculated Property
Cp,gas 459.60 J/mol×K 614.06 Joback Calculated Property
Cp,gas 473.13 J/mol×K 643.11 Joback Calculated Property
Cp,gas 486.09 J/mol×K 672.15 Joback Calculated Property
Cp,gas 498.48 J/mol×K 701.19 Joback Calculated Property
η [0.0001937; 0.0044896] Pa×s [270.89; 526.93] Show Hide
η 0.0044896 Pa×s 270.89 Joback Calculated Property
η 0.0018616 Pa×s 313.56 Joback Calculated Property
η 0.0009531 Pa×s 356.24 Joback Calculated Property
η 0.0005632 Pa×s 398.91 Joback Calculated Property
η 0.0003684 Pa×s 441.58 Joback Calculated Property
η 0.0002597 Pa×s 484.26 Joback Calculated Property
η 0.0001937 Pa×s 526.93 Joback Calculated Property

Correlations

Property Value Unit Temperature (K) Source
Pvap [1.33; 202.65] kPa [369.32; 524.49] The Yaw... Show Hide
Equationln(Pvp) = A + B/(T + C)
Coefficient A1.47715e+01
Coefficient B-4.23199e+03
Coefficient C-7.71340e+01
Temperature range, min.369.32
Temperature range, max.524.49
Pvap 1.33 kPa 369.32 Calculated Property
Pvap 2.99 kPa 386.56 Calculated Property
Pvap 6.15 kPa 403.80 Calculated Property
Pvap 11.77 kPa 421.04 Calculated Property
Pvap 21.19 kPa 438.28 Calculated Property
Pvap 36.14 kPa 455.53 Calculated Property
Pvap 58.83 kPa 472.77 Calculated Property
Pvap 91.96 kPa 490.01 Calculated Property
Pvap 138.69 kPa 507.25 Calculated Property
Pvap 202.65 kPa 524.49 Calculated Property

Similar Compounds

Propanoic acid, 2-methyl-, nonyl ester. Propanoic acid, 2-methyl-, octyl ester. Propanoic acid, 2-methyl-, decyl ester. Eicosyl isobutyrate. Propanoic acid, 2-methyl-, hexyl ester. Propanoic acid, 2-methyl-, pentyl ester. Propanoic acid, heptyl ester. Propanoic acid, dodecyl ester. Propanoic acid, undecyl ester. 1-Docosanol, propanoate. Propanoic acid, octadecyl ester. Propanoic acid, octyl ester. Propanoic acid, hexadecyl ester. Propanoic acid, decyl ester. Propanoic acid, nonyl ester.

Find more compounds similar to Propanoic acid, 2-methyl-, heptyl ester.

Sources

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