Chemical Properties of Succinic acid, 2-fluorophenyl 2-propylphenyl ester

InChI

InChI=1S/C19H19FO4/c1-2-7-14-8-3-5-10-16(14)23-18(21)12-13-19(22)24-17-11-6-4-9-15(17)20/h3-6,8-11H,2,7,12-13H2,1H3

InChI Key

ULZOTMMSWWGIAU-UHFFFAOYSA-N

Formula

C19H19FO4

SMILES

CCCc1ccccc1OC(=O)CCC(=O)Oc1ccccc1F

Molecular Weight¹

330.35

• C_p,gas : Ideal gas heat capacity (J/mol×K).
• Δ_fusH° : Enthalpy of fusion at standard conditions (kJ/mol).
• logP_oct/wat : Octanol/Water partition coefficient.
• McVol : McGowan's characteristic volume (ml/mol).
• I_np : Non-polar retention indices.
• T_boil : Normal Boiling Point Temperature (K).
• T_fus : Normal melting (fusion) point (K).
• ¹: Molecular weight from the IUPAC atomic weights tables.

Physical Properties

Property	Value	Unit	Source
ΔfusH°	44.09	kJ/mol	Joback Calculated Property
logPoct/wat	4.069		Crippen Calculated Property
McVol	247.700	ml/mol	McGowan Calculated Property
Inp	[2330.00; 2330.00]
Inp	2330.00		NIST
Inp	2330.00		NIST
Tboil	633.78	K	Relay (1.0) Calculated Property
Tfus	330.79	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, 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	[340.00; 779.71]	J/mol×K	[273.00; 1000.00]	Joback Predicted correlation
Equation			Y = A + B·T + C·T² + D·T³ + E·T⁴ Y is Cp,gas in J/mol×K, T in K
Coefficient A			3.31400e+00
Coefficient B			1.43422e+00
Coefficient C			-7.65320e-04
Coefficient D			1.07500e-07
Coefficient E			0.00000e+00
Temperature range, min.			273.00
Temperature range, max.			1000.00
Cp,gas	340.00	J/mol×K	273.00	Calculated Property
Cp,gas	419.68	J/mol×K	353.78	Calculated Property
Cp,gas	490.86	J/mol×K	434.56	Calculated Property
Cp,gas	553.88	J/mol×K	515.33	Calculated Property
Cp,gas	609.08	J/mol×K	596.11	Calculated Property
Cp,gas	656.81	J/mol×K	676.89	Calculated Property
Cp,gas	697.39	J/mol×K	757.67	Calculated Property
Cp,gas	731.18	J/mol×K	838.44	Calculated Property
Cp,gas	758.51	J/mol×K	919.22	Calculated Property
Cp,gas	779.71	J/mol×K	1000.00	Calculated Property

Similar Compounds

Find more compounds similar to Succinic acid, 2-fluorophenyl 2-propylphenyl ester.

Sources

• Cheméo Relay (1.0)
• Cheméo Relay (1.0, beta) Beta: served but experimental, data-limited and below our cross-validation release bar; the Joback value is recommended where available.
• Crippen Method
• Crippen Method
• Joback Method
• McGowan Method
• NIST Webbook

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.
Calculated This icon marks a calculated value or equation: a prediction, not a measurement.
These property values are available through the Cheméo API. A free account gives you an access key.