Chemical Properties of Fumaric acid, naphth-2-yl 3-methylbut-2-yl ester

Fumaric acid, naphth-2-yl 3-methylbut-2-yl ester

InChI
InChI=1S/C19H20O4/c1-13(2)14(3)22-18(20)10-11-19(21)23-17-9-8-15-6-4-5-7-16(15)12-17/h4-14H,1-3H3/b11-10+
InChI Key
AOQROGSMGOYKKL-ZHACJKMWSA-N
Formula
C19H20O4
SMILES
CC(C)C(C)OC(=O)/C=C/C(=O)Oc1ccc2ccccc2c1
Molecular Weight1
312.36
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
Δfus 34.37 kJ/mol Joback Calculated Property
IE 8.34 eV Relay (1.0) Calculated Property
logPoct/wat 3.889 Crippen Calculated Property
McVol 245.930 ml/mol McGowan Calculated Property
Inp 2472.00 NIST
Tboil 655.76 K Relay (1.0) Calculated Property
Tfus 382.59 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, 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 [719.87; 790.35] J/mol×K [840.62; 1067.69] Show Hide
Cp,gas 719.87 J/mol×K 840.62 Joback Calculated Property
Cp,gas 734.06 J/mol×K 878.47 Joback Calculated Property
Cp,gas 747.18 J/mol×K 916.31 Joback Calculated Property
Cp,gas 759.30 J/mol×K 954.16 Joback Calculated Property
Cp,gas 770.49 J/mol×K 992.00 Joback Calculated Property
Cp,gas 780.81 J/mol×K 1029.85 Joback Calculated Property
Cp,gas 790.35 J/mol×K 1067.69 Joback Calculated Property
η [0.0000901; 0.0008518] Pa×s [484.77; 840.62] Show Hide
η 0.0008518 Pa×s 484.77 Joback Calculated Property
η 0.0004777 Pa×s 544.08 Joback Calculated Property
η 0.0003001 Pa×s 603.39 Joback Calculated Property
η 0.0002049 Pa×s 662.70 Joback Calculated Property
η 0.0001490 Pa×s 722.00 Joback Calculated Property
η 0.0001137 Pa×s 781.31 Joback Calculated Property
η 0.0000901 Pa×s 840.62 Joback Calculated Property

Similar Compounds

Fumaric acid, naphth-1-yl 3-methylbut-2-yl ester. Fumaric acid, naphth-2-yl 2-methylpent-3-yl ester. Fumaric acid, naphth-1-yl 2-methylpent-3-yl ester. Fumaric acid, 4-chlorophenyl 3-methylbut-2-yl ester. Fumaric acid, 4-methoxyphenyl 3-methylbut-2-yl ester. Fumaric acid, 4-bromophenyl 3-methylbut-2-yl ester. Fumaric acid, 2-chlorophenyl 3-methylbut-2-yl ester. Fumaric acid, 2-methoxyphenyl 3-methylbut-2-yl ester. Fumaric acid, naphth-2-yl hept-2-yl ester. Fumaric acid, naphth-2-yl dec-2-yl ester. Fumaric acid, 4-methoxyphenyl 2-methylpent-3-yl ester. Fumaric acid, 2,4-dichlorophenyl 3-methylbut-2-yl ester. Fumaric acid, 2,5-dichlorophenyl 3-methylbut-2-yl ester. Fumaric acid, 2-isopropoxyphenyl 3-methylbut-2-yl ester. Fumaric acid, 4-bromophenyl 2-methylpent-3-yl ester.

Find more compounds similar to Fumaric acid, naphth-2-yl 3-methylbut-2-yl ester.

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.