Chemical Properties of 2-Propenoic acid, 3-(4-methoxyphenyl)-, 2-octyl ester

2-Propenoic acid, 3-(4-methoxyphenyl)-, 2-octyl ester

InChI
InChI=1S/C18H26O3/c1-4-5-6-7-8-15(2)21-18(19)14-11-16-9-12-17(20-3)13-10-16/h9-15H,4-8H2,1-3H3/b14-11+
InChI Key
OQPRPNQXWIMXCT-SDNWHVSQSA-N
Formula
C18H26O3
SMILES
CCCCCCC(C)OC(=O)/C=C/c1ccc(OC)cc1
Molecular Weight1
290.40
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Physical Properties

Property Value Unit Source
ΔfusH° 38.26 kJ/mol Joback Calculated Property
logPoct/wat 4.611 Crippen Calculated Property
McVol 249.730 ml/mol McGowan Calculated Property
Inp [2320.00; 2320.00]   Show Hide
Inp 2320.00 NIST
Inp 2320.00 NIST
Tboil 627.28 K Relay (1.0) Calculated Property
Tfus 336.89 K Relay (1.0) Calculated Property

Cheméo can also estimate Critical Temperature, Critical Pressure, Critical Volume, Enthalpy of formation at standard conditions, Enthalpy of vaporization at standard conditions, Standard Gibbs free energy of formation, Acentric Factor, Ionization energy, Log10 of Water solubility in mol/l 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 [350.05; 822.97] 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 A1.96500e+00
Coefficient B1.48336e+00
Coefficient C-8.00960e-04
Coefficient D1.38600e-07
Coefficient E0.00000e+00
Temperature range, min.273.00
Temperature range, max.1000.00
Cp,gas 350.05 J/mol×K 273.00 Calculated Property
Cp,gas 432.63 J/mol×K 353.78 Calculated Property
Cp,gas 506.69 J/mol×K 434.56 Calculated Property
Cp,gas 572.65 J/mol×K 515.33 Calculated Property
Cp,gas 630.95 J/mol×K 596.11 Calculated Property
Cp,gas 682.04 J/mol×K 676.89 Calculated Property
Cp,gas 726.34 J/mol×K 757.67 Calculated Property
Cp,gas 764.31 J/mol×K 838.44 Calculated Property
Cp,gas 796.37 J/mol×K 919.22 Calculated Property
Cp,gas 822.96 J/mol×K 1000.00 Calculated Property
Property Value Unit Temperature (K) Source
η [0.0013175; 0.0000795] Pa×s [376.04; 648.35] 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-1.33157e+01
Coefficient B2.51335e+03
Coefficient C0.00000e+00
Coefficient D0.00000e+00
Coefficient E0.00000e+00
CommentLiquid phase. Joback/Reid (1987), valid from Tf to 0.7·Tc.
Temperature range, min.376.04
Temperature range, max.648.35
η 0.0013175 Pa×s 376.04 Calculated Property
η 0.0008009 Pa×s 406.30 Calculated Property
η 0.0005217 Pa×s 436.55 Calculated Property
η 0.0003592 Pa×s 466.81 Calculated Property
η 0.0002588 Pa×s 497.07 Calculated Property
η 0.0001936 Pa×s 527.33 Calculated Property
η 0.0001495 Pa×s 557.58 Calculated Property
η 0.0001186 Pa×s 587.84 Calculated Property
η 0.0000962 Pa×s 618.10 Calculated Property
η 0.0000795 Pa×s 648.35 Calculated Property

Similar Compounds

2-Ethylhexyl trans-4-methoxycinnamate. 2-Propenoic acid, 3-(4-methoxyphenyl)-, 2-ethylhexyl ester. 2-Propenoic acid, 3-phenyl-, cyclohexyl ester. trans-(3-Trifluoromethyl)cinnamin acid, 4-hexadecyl ester. (E)-(1R,2S,4R)-1,7,7-Trimethylbicyclo[2.2.1]heptan-2-yl 3-(benzo[d][1,3]dioxol-5-yl)acrylate. 3-Methylbutyl (E)-isoferulate, TMS. Succinic acid, hept-2-yl 3-phenylprop-2-en-1-yl ester. Succinic acid, dec-2-yl 3-phenylprop-2-en-1-yl ester. 2-Methylbutyl (E)-isoferulate, TMS. 2-Propenoic acid, 3-phenyl-, 1,7,7-trimethylbicyclo[2.2.1]hept-2-yl ester, endo-. (+)-2-Methylbutyl p-((p-methoxybenzylidene)amino)cinnamate. 3-Methyl-3-butenyl (E)-isoferulate, TMS. 3-Methyl-3-butenyl (Z)-isoferulate, TMS. trans-(3-Trifluoromethyl)cinnamic acid, 2-adamantyl ester. 3.beta.-Feruloyloxytropane.

Find more compounds similar to 2-Propenoic acid, 3-(4-methoxyphenyl)-, 2-octyl ester.

Sources

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