Chemical Properties of Hexanoic acid, 4-methyl-, ethyl ester (CAS 1561-10-0)

Hexanoic acid, 4-methyl-, ethyl ester

PDF Excel Molecule Calculator
InChI
InChI=1S/C9H18O2/c1-4-8(3)6-7-9(10)11-5-2/h8H,4-7H2,1-3H3
InChI Key
XLBBXJVJKKWJTQ-UHFFFAOYSA-N
Formula
C9H18O2
SMILES
CCOC(=O)CCC(C)CC
Molecular Weight1
158.24
CAS
1561-10-0
Other Names
  • ethyl 4-methylhexanoate
Cheméo is a service of Céondo GmbH, since 2007, we provide simulation, modelling and software development services for the industry. Do not hesitate to contact us for your projects.

Physical Properties

Property Value Unit Source
Δf -211.46 kJ/mol Joback Calculated Property
Δfgas -479.17 kJ/mol Joback Calculated Property
Δfus 18.33 kJ/mol Joback Calculated Property
Δvap 44.40 kJ/mol Joback Calculated Property
log10WS -2.21 Crippen Calculated Property
logPoct/wat 2.376 Crippen Calculated Property
McVol 145.110 ml/mol McGowan Calculated Property
Pc 2431.44 kPa Joback Calculated Property
Inp [1068.00; 1068.00]   Show Hide
Inp 1068.00 NIST
Inp 1068.00 NIST
Tboil 481.17 K Joback Calculated Property
Tc 658.49 K Joback Calculated Property
Tfus 248.35 K Joback Calculated Property
Vc 0.557 m3/kmol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas [323.06; 397.15] J/mol×K [481.17; 658.49] Show Hide
Cp,gas 323.06 J/mol×K 481.17 Joback Calculated Property
Cp,gas 336.66 J/mol×K 510.72 Joback Calculated Property
Cp,gas 349.76 J/mol×K 540.28 Joback Calculated Property
Cp,gas 362.35 J/mol×K 569.83 Joback Calculated Property
Cp,gas 374.44 J/mol×K 599.38 Joback Calculated Property
Cp,gas 386.04 J/mol×K 628.93 Joback Calculated Property
Cp,gas 397.15 J/mol×K 658.49 Joback Calculated Property
η [0.0002272; 0.0047844] Pa×s [248.35; 481.17] Show Hide
η 0.0047844 Pa×s 248.35 Joback Calculated Property
η 0.0020429 Pa×s 287.15 Joback Calculated Property
η 0.0010682 Pa×s 325.96 Joback Calculated Property
η 0.0006412 Pa×s 364.76 Joback Calculated Property
η 0.0004246 Pa×s 403.56 Joback Calculated Property
η 0.0003022 Pa×s 442.37 Joback Calculated Property
η 0.0002272 Pa×s 481.17 Joback Calculated Property

Correlations

Property Value Unit Temperature (K) Source
Pvap [1.33; 202.63] kPa [339.52; 485.22] The Yaw... Show Hide
Equationln(Pvp) = A + B/(T + C)
Coefficient A1.47036e+01
Coefficient B-3.92684e+03
Coefficient C-6.71260e+01
Temperature range, min.339.52
Temperature range, max.485.22
Pvap 1.33 kPa 339.52 Calculated Property
Pvap 2.99 kPa 355.71 Calculated Property
Pvap 6.17 kPa 371.90 Calculated Property
Pvap 11.81 kPa 388.09 Calculated Property
Pvap 21.25 kPa 404.28 Calculated Property
Pvap 36.24 kPa 420.46 Calculated Property
Pvap 58.97 kPa 436.65 Calculated Property
Pvap 92.11 kPa 452.84 Calculated Property
Pvap 138.80 kPa 469.03 Calculated Property
Pvap 202.63 kPa 485.22 Calculated Property

Similar Compounds

Heptanoic acid, 4-methyl-, ethyl ester. Octanoic acid, 4-methyl-, ethyl ester. 3-Cyclopentylpropionic acid, ethyl ester. Octadecanoic acid, 10-methyl-, ethyl ester. Ethyl 5-methylhexanoate. Nonanoic acid, 5-methyl-, ethyl ester. Pentanoic acid, 4-methyl-, ethyl ester. Hexanoic acid, 4-methyl-, methyl ester. Cyclohexanepropionic acid, 4-oxo-, ethyl ester. Heptanedioic acid, 4-methyl-, dimethyl ester. 4-Methylheptanoic acid, methyl ester. Octanoic acid, 4,6-dimethyl-, methyl ester, (4S,6S)-(+)-. Octanoic acid, 4-methyl-, methyl ester. Octadecanoic acid, 4-methyl-, methyl ester. Methyl 4-methylnonanoate.

Find more compounds similar to Hexanoic acid, 4-methyl-, ethyl ester.

Sources

Note: Cheméo is only indexing the data, follow the source links to retrieve the latest data. The source is also providing more information like the publication year, authors and more. Take the time to validate and double check the source of the data.