Chemical Properties of 3-Methylbut-2-enoic acid, 4-methoxy-2-methylbutyl ester

3-Methylbut-2-enoic acid, 4-methoxy-2-methylbutyl ester

InChI
InChI=1S/C11H20O3/c1-9(2)7-11(12)14-8-10(3)5-6-13-4/h7,10H,5-6,8H2,1-4H3
InChI Key
HUBXSBGOYZNBHQ-UHFFFAOYSA-N
Formula
C11H20O3
SMILES
COCCC(C)COC(=O)C=C(C)C
Molecular Weight1
200.28
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Physical Properties

Property Value Unit Source
ΔfusH° 25.17 kJ/mol Joback Calculated Property
ΔvapH° 66.36 kJ/mol Relay (1.0) Calculated Property
logPoct/wat 2.168 Crippen Calculated Property
McVol 174.860 ml/mol McGowan Calculated Property
Inp 1421.00 NIST
Tboil 515.02 K Relay (1.0) Calculated Property

Cheméo can also estimate Normal melting (fusion) point, Critical Temperature, Critical Pressure, Critical Volume, Enthalpy of formation 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 [256.41; 583.12] 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 A2.82430e+01
Coefficient B9.56680e-01
Coefficient C-4.58300e-04
Coefficient D5.65000e-08
Coefficient E0.00000e+00
Temperature range, min.273.00
Temperature range, max.1000.00
Cp,gas 256.41 J/mol×K 273.00 Calculated Property
Cp,gas 311.84 J/mol×K 353.78 Calculated Property
Cp,gas 362.07 J/mol×K 434.56 Calculated Property
Cp,gas 407.27 J/mol×K 515.33 Calculated Property
Cp,gas 447.64 J/mol×K 596.11 Calculated Property
Cp,gas 483.35 J/mol×K 676.89 Calculated Property
Cp,gas 514.57 J/mol×K 757.67 Calculated Property
Cp,gas 541.49 J/mol×K 838.44 Calculated Property
Cp,gas 564.28 J/mol×K 919.22 Calculated Property
Cp,gas 583.12 J/mol×K 1000.00 Calculated Property

Similar Compounds

3-Methylbut-2-enoic acid, 2-methylpentyl ester. 3-Methyl-2-butenoic acid, 3-methylbutyl ester. Isobutyric acid, 4-methoxy-2-methylbutyl ester. Isovaleric acid, 4-methoxy-2-methylbutyl ester. Chloroacetic acid, 4-methoxy-2-methylbutyl ester. Fumaric acid, di(2-(2-methoxyethyl)hexyl) ester. Glutaric acid, di(4-methoxy-2-methylbutyl) ester. Glutaric acid, isobutyl 4-methoxy-2-methylbutyl ester. Glutaric acid, ethyl 4-methoxy-2-methylbutyl ester. Glutaric acid, 3-methylbut-2-en-1-yl 2-methylbutyl ester. Glutaric acid, 4-methoxy-2-methylbutyl propyl ester. Glutaric acid, butyl 4-methoxy-2-methylbutyl ester. Cyclopropanecarboxylic acid, 4-methoxy-2-methylbutyl ester. Succinic acid, 3-methylbut-2-en-1-yl 2-methylpentyl ester. Glutaric acid, 4-methoxy-2-methylbutyl pentyl ester.

Find more compounds similar to 3-Methylbut-2-enoic acid, 4-methoxy-2-methylbutyl ester.

Sources

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