Chemical Properties of Dimethylmalonic acid, isohexyl 2-pentyl ester

Dimethylmalonic acid, isohexyl 2-pentyl ester

InChI
InChI=1S/C16H30O4/c1-7-9-13(4)20-15(18)16(5,6)14(17)19-11-8-10-12(2)3/h12-13H,7-11H2,1-6H3
InChI Key
NHLNWTNZZXFAIY-UHFFFAOYSA-N
Formula
C16H30O4
SMILES
CCCC(C)OC(=O)C(C)(C)C(=O)OCCCC(C)C
Molecular Weight1
286.41
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Physical Properties

Property Value Unit Source
ΔfH°gas -1035.71 kJ/mol Relay (1.0) Calculated Property
ΔfusH° 31.47 kJ/mol Joback Calculated Property
ΔvapH° 74.13 kJ/mol Relay (1.0) Calculated Property
logPoct/wat 3.724 Crippen Calculated Property
McVol 251.180 ml/mol McGowan Calculated Property
Inp 1661.00 NIST
Tboil 534.28 K Relay (1.0) Calculated Property

Cheméo can also estimate Normal melting (fusion) point, Critical Temperature, Critical Pressure, 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.

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas [721.78; 814.27] J/mol×K [678.01; 859.67] Show Hide
Cp,gas 721.78 J/mol×K 678.01 Joback Calculated Property
Cp,gas 739.62 J/mol×K 708.29 Joback Calculated Property
Cp,gas 756.47 J/mol×K 738.56 Joback Calculated Property
Cp,gas 772.33 J/mol×K 768.84 Joback Calculated Property
Cp,gas 787.24 J/mol×K 799.12 Joback Calculated Property
Cp,gas 801.21 J/mol×K 829.40 Joback Calculated Property
Cp,gas 814.27 J/mol×K 859.67 Joback Calculated Property
η [0.0000550; 0.0055065] Pa×s [327.16; 678.01] Show Hide
η 0.0055065 Pa×s 327.16 Joback Calculated Property
η 0.0014276 Pa×s 385.63 Joback Calculated Property
η 0.0005281 Pa×s 444.11 Joback Calculated Property
η 0.0002462 Pa×s 502.58 Joback Calculated Property
η 0.0001346 Pa×s 561.06 Joback Calculated Property
η 0.0000825 Pa×s 619.53 Joback Calculated Property
η 0.0000550 Pa×s 678.01 Joback Calculated Property

Similar Compounds

Dimethylmalonic acid, isohexyl 4-octyl ester. Dimethylmalonic acid, cis-4-methylcyclohexyl hexyl ester. Dimethylmalonic acid, hexyl trans-4-methylcyclohexyl ester. Dimethylmalonic acid, pentyl trans-4-methylcyclohexyl ester. Dimethylmalonic acid, cis-4-methylcyclohexyl pentyl ester. Dimethylmalonic acid, heptyl trans-4-methylcyclohexyl ester. Dimethylmalonic acid, cis-4-methylcyclohexyl heptyl ester. Dimethylmalonic acid, decyl trans-4-methylcyclohexyl ester. Dimethylmalonic acid, cis-4-methylcyclohexyl octadecyl ester. Dimethylmalonic acid, octyl trans-4-methylcyclohexyl ester. Dimethylmalonic acid, cis-4-methylcyclohexyl tetradecyl ester. Dimethylmalonic acid, cis-4-methylcyclohexyl dodecyl ester. Dimethylmalonic acid, cis-4-methylcyclohexyl decyl ester. Dimethylmalonic acid, cis-4-methylcyclohexyl tridecyl ester. Dimethylmalonic acid, tetradecyl trans-4-methylcyclohexyl ester.

Find more compounds similar to Dimethylmalonic acid, isohexyl 2-pentyl ester.

Sources

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