Chemical Properties of Glutaric acid, but-3-yn-2-yl 3-fluorophenyl ester

Glutaric acid, but-3-yn-2-yl 3-fluorophenyl ester

InChI
InChI=1S/C15H15FO4/c1-3-11(2)19-14(17)8-5-9-15(18)20-13-7-4-6-12(16)10-13/h1,4,6-7,10-11H,5,8-9H2,2H3
InChI Key
LJUCPGNZNKNEIU-UHFFFAOYSA-N
Formula
C15H15FO4
SMILES
C#CC(C)OC(=O)CCCC(=O)Oc1cccc(F)c1
Molecular Weight1
278.28
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
Δfus 39.53 kJ/mol Joback Calculated Property
logPoct/wat 2.466 Crippen Calculated Property
McVol 206.500 ml/mol McGowan Calculated Property
Inp [1856.00; 1856.00]   Show Hide
Inp 1856.00 NIST
Inp 1856.00 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.

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas [544.57; 613.55] J/mol×K [679.85; 885.72] Show Hide
Cp,gas 544.57 J/mol×K 679.85 Joback Calculated Property
Cp,gas 558.46 J/mol×K 714.16 Joback Calculated Property
Cp,gas 571.37 J/mol×K 748.47 Joback Calculated Property
Cp,gas 583.31 J/mol×K 782.79 Joback Calculated Property
Cp,gas 594.31 J/mol×K 817.10 Joback Calculated Property
Cp,gas 604.39 J/mol×K 851.41 Joback Calculated Property
Cp,gas 613.55 J/mol×K 885.72 Joback Calculated Property

Similar Compounds

Glutaric acid, 2-fluorophenyl but-3-yn-2-yl ester. Succinic acid, but-3-yn-2-yl 3-fluorophenyl ester. Glutaric acid, hex-4-yn-3-yl 3-fluorophenyl ester. Glutaric acid, ethyl 3-fluorophenyl ester. Glutaric acid, 1,1,1-trifluoroprop-2-yl 3-fluorophenyl ester. Glutaric acid, but-3-yn-2-yl 4-fluoro-2-methoxyphenyl ester. Glutaric acid, but-3-yn-2-yl 3-chlorophenyl ester. Glutaric acid, but-3-yn-2-yl 2-chlorophenyl ester. Glutaric acid, 2-fluorophenyl isopropyl ester. Glutaric acid, 3-fluorophenyl propyl ester. Glutaric acid, but-3-yn-2-yl 2-bromo-4-fluorophenyl ester. Glutaric acid, 2,2-dichloroethyl 3-fluorophenyl ester. Glutaric acid, butyl 3-fluorophenyl ester. Glutaric acid, but-3-yl-2-yn 4-bromophenyl ester. Glutaric acid, but-3-yl-2-yn 1-naphthyl ester.

Find more compounds similar to Glutaric acid, but-3-yn-2-yl 3-fluorophenyl 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.