Chemical Properties of Succinic acid, 2-chloro-6-fluorophenyl 3-phenylprop-2-en-1-yl ester

InChI

InChI=1S/C19H16ClFO4/c20-15-9-4-10-16(21)19(15)25-18(23)12-11-17(22)24-13-5-8-14-6-2-1-3-7-14/h1-10H,11-13H2/b8-5+

InChI Key

FUMADRXELDDAQT-VMPITWQZSA-N

Formula

C19H16ClFO4

SMILES

O=C(CCC(=O)Oc1c(F)cccc1Cl)OCC=Cc1ccccc1

Molecular Weight¹

362.78

• C_p,gas : Ideal gas heat capacity (J/mol×K).
• Δ_fusH° : Enthalpy of fusion at standard conditions (kJ/mol).
• log₁₀WS : Log10 of Water solubility in mol/l.
• 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).
• ¹: Molecular weight from the IUPAC atomic weights tables.

Physical Properties

Property	Value	Unit	Source
ΔfusH°	48.49	kJ/mol	Joback Calculated Property
log10WS	-5.40		Relay (1.0) Calculated Property
logPoct/wat	4.421		Crippen Calculated Property
McVol	255.640	ml/mol	McGowan Calculated Property
Inp	[2762.00; 2762.00]
Inp	2762.00		NIST
Inp	2762.00		NIST
Tboil	646.12	K	Relay (1.0) Calculated Property

Cheméo can also estimate 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 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	[717.96; 772.21]	J/mol×K	[854.94; 1080.29]
Cp,gas	717.96	J/mol×K	854.94	Joback Calculated Property
Cp,gas	729.86	J/mol×K	892.50	Joback Calculated Property
Cp,gas	740.55	J/mol×K	930.06	Joback Calculated Property
Cp,gas	750.08	J/mol×K	967.62	Joback Calculated Property
Cp,gas	758.50	J/mol×K	1005.17	Joback Calculated Property
Cp,gas	765.86	J/mol×K	1042.73	Joback Calculated Property
Cp,gas	772.21	J/mol×K	1080.29	Joback Calculated Property

Similar Compounds

Find more compounds similar to Succinic acid, 2-chloro-6-fluorophenyl 3-phenylprop-2-en-1-yl 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.
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