Chemical Properties of Succinic acid, 1,1,1-trifluoroprop-2-yl adamant-2-yl ester

Succinic acid, 1,1,1-trifluoroprop-2-yl adamant-2-yl ester

InChI
InChI=1S/C17H23F3O4/c1-9(17(18,19)20)23-14(21)2-3-15(22)24-16-12-5-10-4-11(7-12)8-13(16)6-10/h9-13,16H,2-8H2,1H3
InChI Key
LRMRJPJOMJVPLJ-UHFFFAOYSA-N
Formula
C17H23F3O4
SMILES
CC(OC(=O)CCC(=O)OC1C2CC3CC(C2)CC1C3)C(F)(F)F
Molecular Weight1
348.36
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
ΔfusH° 41.27 kJ/mol Joback Calculated Property
logPoct/wat 3.628 Crippen Calculated Property
McVol 238.000 ml/mol McGowan Calculated Property
Inp [1990.00; 1990.00]   Show Hide
Inp 1990.00 NIST
Inp 1990.00 NIST

Cheméo can also estimate Normal Boiling Point Temperature, Normal melting (fusion) point, 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, 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 [350.92; 890.12] 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 A-1.13598e+02
Coefficient B2.06642e+00
Coefficient C-1.43940e-03
Coefficient D3.76700e-07
Coefficient E0.00000e+00
Temperature range, min.273.00
Temperature range, max.1000.00
Cp,gas 350.92 J/mol×K 273.00 Calculated Property
Cp,gas 453.98 J/mol×K 353.78 Calculated Property
Cp,gas 543.47 J/mol×K 434.56 Calculated Property
Cp,gas 620.59 J/mol×K 515.33 Calculated Property
Cp,gas 686.52 J/mol×K 596.11 Calculated Property
Cp,gas 742.46 J/mol×K 676.89 Calculated Property
Cp,gas 789.60 J/mol×K 757.67 Calculated Property
Cp,gas 829.13 J/mol×K 838.44 Calculated Property
Cp,gas 862.24 J/mol×K 919.22 Calculated Property
Cp,gas 890.12 J/mol×K 1000.00 Calculated Property

Similar Compounds

Succinic acid, 1,1,1-trifluoroprop-2-yl 1-cyclopentylethyl ester. Glutaric acid, 2-ethylcyclohexyl 1,1,1-trifluoroprop-2-yl ester. Glutaric acid, 2-norbornyl 1,1,1-trifluoroprop-2-yl ester. Succinic acid, 3-methylbut-2-yl adamant-2-yl ester. Glutaric acid, 1-cyclopentylethyl 1,1,1-trifluoroprop-2-yl ester. Succinic acid, 1,1,1-trifluoroprop-2-yl trans-4-methylcyclohexyl ester. Succinic acid, 1,1,1-trifluoroprop-2-yl cis-4-methylcyclohexyl ester. Succinic acid, dec-2-yl adamant-2-yl ester. Succinic acid, hept-2-yl adamant-2-yl ester. Succinic acid, 1,1,1-trifluoroprop-2-yl cis-4-tert-butylcyclohexyl ester. Succinic acid, 1,1,1-trifluoroprop-2-yl trans-4-tert-butylcyclohexyl ester. Succinic acid, 2-methylpent-3-yl adamant-2-yl ester. Succinic acid, cyclohexylmethyl 1,1,1-trifluoroprop-2-yl ester. Succinic acid, 2,2,3,3-tetrafluoropropyl adamant-2-yl ester. Succinic acid, cyclohexylmethyl adamant-2-yl ester.

Find more compounds similar to Succinic acid, 1,1,1-trifluoroprop-2-yl adamant-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.