Chemical Properties of Cyclohexyl nonadecanoate

Cyclohexyl nonadecanoate

InChI
InChI=1S/C25H48O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-20-23-25(26)27-24-21-18-17-19-22-24/h24H,2-23H2,1H3
InChI Key
WQIYPLDSWWUFLK-UHFFFAOYSA-N
Formula
C25H48O2
SMILES
CCCCCCCCCCCCCCCCCCC(=O)OC1CCCCC1
Molecular Weight1
380.65
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
ω 1.0535 Relay (1.0) Calculated Property
ΔfH°gas -845.86 kJ/mol Relay (1.0) Calculated Property
ΔfusH° 56.71 kJ/mol Joback Calculated Property
ΔvapH° 123.39 kJ/mol Relay (1.0) Calculated Property
IE 9.91 eV Relay (1.0) Calculated Property
log10WS -8.21 Relay (1.0) Calculated Property
logPoct/wat 8.514 Crippen Calculated Property
McVol 359.690 ml/mol McGowan Calculated Property
Pc 861.00 kPa Joback Calculated Property
Inp 2722.00 NIST
Tboil 645.69 K Relay (1.0) Calculated Property
Tc 857.09 K Relay (1.0) Calculated Property
Tfus 305.54 K Relay (1.0) Calculated Property
Vc 1.380 m3/kmol Relay (1.0) Calculated Property

Cheméo can also estimate Standard Gibbs free energy of formation for this compound, but it falls outside the models' validated range, so it is not shown here. Open the prediction tool to compute it on demand.

Correlations

Property Value Unit Temperature (K) Source
Cp,gas [514.04; 1302.29] J/mol×K [273.00; 1000.00] Joback Predicted correlation Show Hide
EquationY = A + B·T + C·T² + D·T³ + E·T⁴
Y is Cp,gas in J/mol×K, T in K
Coefficient A-6.00330e+01
Coefficient B2.44612e+00
Coefficient C-1.32260e-03
Coefficient D2.38800e-07
Coefficient E0.00000e+00
Temperature range, min.273.00
Temperature range, max.1000.00
Cp,gas 514.04 J/mol×K 273.00 Calculated Property
Cp,gas 650.39 J/mol×K 353.78 Calculated Property
Cp,gas 772.78 J/mol×K 434.56 Calculated Property
Cp,gas 881.97 J/mol×K 515.33 Calculated Property
Cp,gas 978.73 J/mol×K 596.11 Calculated Property
Cp,gas 1063.79 J/mol×K 676.89 Calculated Property
Cp,gas 1137.93 J/mol×K 757.67 Calculated Property
Cp,gas 1201.88 J/mol×K 838.44 Calculated Property
Cp,gas 1256.42 J/mol×K 919.22 Calculated Property
Cp,gas 1302.29 J/mol×K 1000.00 Calculated Property
Property Value Unit Temperature (K) Source
η [0.0014717; 0.0000608] Pa×s [421.22; 729.12] Joback Predicted correlation Show Hide
EquationY = exp(A + B/T + C·ln(T) + D·T^E)
Y is η in Pa×s, T in K
Coefficient A-1.40671e+01
Coefficient B3.17843e+03
Coefficient C0.00000e+00
Coefficient D0.00000e+00
Coefficient E0.00000e+00
Temperature range, min.421.22
Temperature range, max.729.12
η 0.0014717 Pa×s 421.22 Calculated Property
η 0.0008349 Pa×s 455.43 Calculated Property
η 0.0005127 Pa×s 489.64 Calculated Property
η 0.0003356 Pa×s 523.85 Calculated Property
η 0.0002313 Pa×s 558.06 Calculated Property
η 0.0001665 Pa×s 592.27 Calculated Property
η 0.0001242 Pa×s 626.48 Calculated Property
η 0.0000955 Pa×s 660.69 Calculated Property
η 0.0000754 Pa×s 694.91 Calculated Property
η 0.0000608 Pa×s 729.12 Calculated Property

Similar Compounds

Cyclohexyl heptadecanoate. Cyclohexyl stearate. Cyclohexyl nonanoate. Cyclohexyl pentadecanoate. Cyclohexyl myristate. DECANOIC ACID, CYCLOHEXYL ESTER. OCTANOIC ACID, CYCLOHEXYL ESTER. Hexadecanoic acid, cyclohexyl ester. Cyclohexyl tridecanoate. Cyclohexyl undecanoate. Cyclohexyl heptanoate. 10-Oxahexadecanolide. Pimelic acid, di(4-octyl) ester. Sebacic acid, di(4-octyl) ester. 2-Oxepanone, 7-hexyl-.

Find more compounds similar to Cyclohexyl nonadecanoate.

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.
These property values are available through the Cheméo API. A free account gives you an access key.