Chemical Properties of 1-Methyl-2-methoxyethyl 3,4-dimethylbenzoate

1-Methyl-2-methoxyethyl 3,4-dimethylbenzoate

InChI
InChI=1S/C13H18O3/c1-9-5-6-12(7-10(9)2)13(14)16-11(3)8-15-4/h5-7,11H,8H2,1-4H3
InChI Key
CQTKEDOOURVIIM-UHFFFAOYSA-N
Formula
C13H18O3
SMILES
COCC(C)OC(=O)c1ccc(C)c(C)c1
Molecular Weight1
222.28
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
Δfgas -529.24 kJ/mol Relay (1.0) Calculated Property
Δfus 24.72 kJ/mol Joback Calculated Property
logPoct/wat 2.495 Crippen Calculated Property
McVol 183.580 ml/mol McGowan Calculated Property
Pc 2125.60 kPa Joback Calculated Property
Inp 1620.00 NIST
Tboil 563.14 K Relay (1.0) Calculated Property
Tc 760.62 K Relay (1.0) Calculated Property
Tfus 282.58 K Relay (1.0) Calculated Property

Cheméo can also estimate Critical Volume, 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.

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas [464.29; 545.68] J/mol×K [613.88; 818.47] Show Hide
Cp,gas 464.29 J/mol×K 613.88 Joback Calculated Property
Cp,gas 479.97 J/mol×K 647.98 Joback Calculated Property
Cp,gas 494.80 J/mol×K 682.08 Joback Calculated Property
Cp,gas 508.79 J/mol×K 716.17 Joback Calculated Property
Cp,gas 521.93 J/mol×K 750.27 Joback Calculated Property
Cp,gas 534.22 J/mol×K 784.37 Joback Calculated Property
Cp,gas 545.68 J/mol×K 818.47 Joback Calculated Property
η [0.0001088; 0.0016063] Pa×s [337.29; 613.88] Show Hide
η 0.0016063 Pa×s 337.29 Joback Calculated Property
η 0.0007832 Pa×s 383.39 Joback Calculated Property
η 0.0004455 Pa×s 429.49 Joback Calculated Property
η 0.0002827 Pa×s 475.59 Joback Calculated Property
η 0.0001944 Pa×s 521.68 Joback Calculated Property
η 0.0001421 Pa×s 567.78 Joback Calculated Property
η 0.0001088 Pa×s 613.88 Joback Calculated Property

Similar Compounds

1-Methyl-2-methoxyethyl m-toluate. 2-Methoxyethyl 3,4-dimethylbenzoate. 1-Methyl-2-methoxyethyl benzoate. 1-Methyl-2-methoxyethyl 4-tert-butylbenzoate. Butyl 3,4-dimethylbenzoate. 1-Propanol, 2-[2-(benzoyloxy)propoxy]-, benzoate. 3-Methylbenzoic acid, 2-methoxyethyl ester. 1-Methyl-2-methoxyethyl 2-phenoxybenzoate. Hexyl 3,4-dimethylbenzoate. Benzoic acid, 3,4-dimethyl-, ethyl ester. Benzoic acid, 3-methyl-, 4-methoxy-2-methylbutyl ester. 1,1'-Oxy-di-2-propanol di-p-nitro benzoate. m-Toluic acid, 2-tetradecyl ester. m-Toluic acid, 2-pentadecyl ester. m-Toluic acid, 2-tridecyl ester.

Find more compounds similar to 1-Methyl-2-methoxyethyl 3,4-dimethylbenzoate.

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.