Chemical Properties of Succinic acid, 3-methylbut-2-en-1-yl 2-methylpentyl ester

Succinic acid, 3-methylbut-2-en-1-yl 2-methylpentyl ester

InChI
InChI=1S/C15H26O4/c1-5-6-13(4)11-19-15(17)8-7-14(16)18-10-9-12(2)3/h9,13H,5-8,10-11H2,1-4H3
InChI Key
OPKRPJNPSDWCGK-UHFFFAOYSA-N
Formula
C15H26O4
SMILES
CCCC(C)COC(=O)CCC(=O)OCC=C(C)C
Molecular Weight1
270.36
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Physical Properties

Property Value Unit Source
ΔfH°gas -899.93 kJ/mol Relay (1.0) Calculated Property
ΔfusH° 38.71 kJ/mol Joback Calculated Property
ΔvapH° 80.50 kJ/mol Relay (1.0) Calculated Property
logPoct/wat 3.255 Crippen Calculated Property
McVol 232.790 ml/mol McGowan Calculated Property
Pc 1498.83 kPa Joback Calculated Property
Inp [1818.00; 1818.00]   Show Hide
Inp 1818.00 NIST
Inp 1818.00 NIST
Tboil 569.59 K Relay (1.0) Calculated Property
Tc 732.92 K Relay (1.0) Calculated Property

Cheméo can also estimate Normal melting (fusion) point, Critical Volume, 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 [342.20; 779.10] 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 A2.45160e+01
Coefficient B1.34508e+00
Coefficient C-6.92300e-04
Coefficient D1.01800e-07
Coefficient E0.00000e+00
Temperature range, min.273.00
Temperature range, max.1000.00
Cp,gas 342.20 J/mol×K 273.00 Calculated Property
Cp,gas 418.24 J/mol×K 353.78 Calculated Property
Cp,gas 486.65 J/mol×K 434.56 Calculated Property
Cp,gas 547.76 J/mol×K 515.33 Calculated Property
Cp,gas 601.89 J/mol×K 596.11 Calculated Property
Cp,gas 649.36 J/mol×K 676.89 Calculated Property
Cp,gas 690.49 J/mol×K 757.67 Calculated Property
Cp,gas 725.61 J/mol×K 838.44 Calculated Property
Cp,gas 755.04 J/mol×K 919.22 Calculated Property
Cp,gas 779.10 J/mol×K 1000.00 Calculated Property

Similar Compounds

Succinic acid, 2-ethylhexyl 3-methylbut-2-en-1-yl ester. Glutaric acid, 3-methylbut-2-en-1-yl 2-methylpentyl ester. Succinic acid, cyclohexylmethyl 3-methylbut-2-en-1-yl ester. Glutaric acid, 3-methylbut-2-en-1-yl 2-ethylhexyl ester. Glutaric acid, 3-methylbut-2-en-1-yl 2,4,4-trimethylpentyl ester. Glutaric acid, 3-methylbut-2-en-1-yl 2-ethylbutyl ester. Succinic acid, 3-methylbut-2-en-1-yl 3-methylpentyl ester. Succinic acid, 2-ethylhexyl but-2-en-1-yl ester. Glutaric acid, 3-methylbut-2-en-1-yl 2-methylbutyl ester. Succinic acid, cyclohexylmethyl but-2-en-1-yl ester. Succinic acid, 2-ethylhexyl cis-pent-2-en-1-yl ester. Succinic acid, cyclohexylmethyl cis-pent-2-en-1-yl ester. Glutaric acid, isohexyl 3-methylbut-2-enyl ester. Sebacic acid, isohexyl 3-methylbut-2-enyl ester. Succinic acid, cyclohexylmethyl cis-hex-2-en-1-yl ester.

Find more compounds similar to Succinic acid, 3-methylbut-2-en-1-yl 2-methylpentyl ester.

Sources

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