Chemical Properties of Glutaric acid, 2-methylphenyl propyl ester

Glutaric acid, 2-methylphenyl propyl ester

InChI
InChI=1S/C15H20O4/c1-3-11-18-14(16)9-6-10-15(17)19-13-8-5-4-7-12(13)2/h4-5,7-8H,3,6,9-11H2,1-2H3
InChI Key
LHSUKJACOYSYIX-UHFFFAOYSA-N
Formula
C15H20O4
SMILES
CCCOC(=O)CCCC(=O)Oc1ccccc1C
Molecular Weight1
264.32
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
ΔfH°gas -738.39 kJ/mol Relay (1.0) Calculated Property
ΔfusH° 37.00 kJ/mol Joback Calculated Property
ΔvapH° 83.45 kJ/mol Relay (1.0) Calculated Property
IE 8.39 eV Relay (1.0) Calculated Property
log10WS -3.15 Relay (1.0) Calculated Property
logPoct/wat 3.024 Crippen Calculated Property
McVol 213.330 ml/mol McGowan Calculated Property
Pc 1838.84 kPa Joback Calculated Property
Inp 1986.00 NIST
Tboil 596.72 K Relay (1.0) Calculated Property
Tc 789.80 K Relay (1.0) Calculated Property
Tfus 281.38 K Relay (1.0) Calculated Property

Cheméo can also estimate Critical Volume, Standard Gibbs free energy of formation, Acentric Factor for this compound, but they fall outside the models' validated range, so they are not shown here. Open the prediction tool to compute them on demand.

Correlations

Property Value Unit Temperature (K) Source
Cp,gas [301.66; 687.84] 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 A2.04650e+01
Coefficient B1.18084e+00
Coefficient C-5.67160e-04
Coefficient D5.37000e-08
Coefficient E0.00000e+00
Temperature range, min.273.00
Temperature range, max.1000.00
Cp,gas 301.66 J/mol×K 273.00 Calculated Property
Cp,gas 369.61 J/mol×K 353.78 Calculated Property
Cp,gas 430.91 J/mol×K 434.56 Calculated Property
Cp,gas 485.72 J/mol×K 515.33 Calculated Property
Cp,gas 534.21 J/mol×K 596.11 Calculated Property
Cp,gas 576.56 J/mol×K 676.89 Calculated Property
Cp,gas 612.92 J/mol×K 757.67 Calculated Property
Cp,gas 643.48 J/mol×K 838.44 Calculated Property
Cp,gas 668.40 J/mol×K 919.22 Calculated Property
Cp,gas 687.84 J/mol×K 1000.00 Calculated Property
Property Value Unit Temperature (K) Source
η [0.0015384; 0.0001249] Pa×s [382.41; 623.30] 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-1.29738e+01
Coefficient B2.48444e+03
Coefficient C0.00000e+00
Coefficient D0.00000e+00
Coefficient E0.00000e+00
Temperature range, min.382.41
Temperature range, max.623.30
η 0.0015384 Pa×s 382.41 Calculated Property
η 0.0010058 Pa×s 409.18 Calculated Property
η 0.0006928 Pa×s 435.94 Calculated Property
η 0.0004982 Pa×s 462.71 Calculated Property
η 0.0003715 Pa×s 489.47 Calculated Property
η 0.0002855 Pa×s 516.24 Calculated Property
η 0.0002252 Pa×s 543.00 Calculated Property
η 0.0001817 Pa×s 569.77 Calculated Property
η 0.0001494 Pa×s 596.53 Calculated Property
η 0.0001249 Pa×s 623.30 Calculated Property

Similar Compounds

Glutaric acid, butyl 2-methylphenyl ester. Glutaric acid, ethyl 2-methylphenyl ester. Glutaric acid, 2-methylphenyl pentyl ester. Pimelic acid, 2-methylphenyl propyl ester. Glutaric acid, isobutyl 2-methylphenyl ester. Sebacic acid, 2-methylphenyl propyl ester. Glutaric acid, hexyl 2-methylphenyl ester. Glutaric acid, dodecyl 2-methylphenyl ester. Glutaric acid, 2-methylphenyl tetradecyl ester. Glutaric acid, 2-methylphenyl tridecyl ester. Glutaric acid, heptyl 2-methylphenyl ester. Glutaric acid, 2-methylphenyl pentadecyl ester. Glutaric acid, hexadecyl 2-methylphenyl ester. Glutaric acid, heptadecyl 2-methylphenyl ester. Glutaric acid, 2-methylphenyl octyl ester.

Find more compounds similar to Glutaric acid, 2-methylphenyl propyl 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.
These property values are available through the Cheméo API. A free account gives you an access key.