Chemical Properties of Succinic acid, 2-fluorophenethyl pentadecyl ester

InChI

InChI=1S/C27H43FO4/c1-2-3-4-5-6-7-8-9-10-11-12-13-16-22-31-26(29)19-20-27(30)32-23-21-24-17-14-15-18-25(24)28/h14-15,17-18H,2-13,16,19-23H2,1H3

InChI Key

FVFJYEZMXBCACX-UHFFFAOYSA-N

Formula

C27H43FO4

SMILES

CCCCCCCCCCCCCCCOC(=O)CCC(=O)OCCc1ccccc1F

Molecular Weight¹

450.63

• C_p,gas : Ideal gas heat capacity (J/mol×K).
• Δ_fG° : Standard Gibbs free energy of formation (kJ/mol).
• Δ_fH°_gas : Enthalpy of formation at standard conditions (kJ/mol).
• Δ_fusH° : Enthalpy of fusion at standard conditions (kJ/mol).
• Δ_vapH° : Enthalpy of vaporization 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).
• P_c : Critical Pressure (kPa).
• I_np : Non-polar retention indices.
• T_boil : Normal Boiling Point Temperature (K).
• T_c : Critical Temperature (K).
• T_fus : Normal melting (fusion) point (K).
• V_c : Critical Volume (m³/kmol).
• ¹: Molecular weight from the IUPAC atomic weights tables.

Physical Properties

Property	Value	Unit	Source
ΔfG°	-383.41	kJ/mol	Joback Calculated Property
ΔfH°gas	-1061.26	kJ/mol	Joback Calculated Property
ΔfusH°	67.99	kJ/mol	Joback Calculated Property
ΔvapH°	96.13	kJ/mol	Joback Calculated Property
log10WS	-8.28		Crippen Calculated Property
logPoct/wat	7.326		Crippen Calculated Property
McVol	384.180	ml/mol	McGowan Calculated Property
Pc	841.62	kPa	Joback Calculated Property
Inp	[3139.00; 3139.00]
Inp	3139.00		NIST
Inp	3139.00		NIST
Tboil	1000.67	K	Joback Calculated Property
Tc	1229.47	K	Joback Calculated Property
Tfus	577.90	K	Joback Calculated Property
Vc	1.506	m3/kmol	Joback Calculated Property

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[1313.16; 1396.71]	J/mol×K	[1000.67; 1229.47]
Cp,gas	1313.16	J/mol×K	1000.67	Joback Calculated Property
Cp,gas	1331.08	J/mol×K	1038.80	Joback Calculated Property
Cp,gas	1347.32	J/mol×K	1076.94	Joback Calculated Property
Cp,gas	1361.94	J/mol×K	1115.07	Joback Calculated Property
Cp,gas	1375.00	J/mol×K	1153.21	Joback Calculated Property
Cp,gas	1386.57	J/mol×K	1191.34	Joback Calculated Property
Cp,gas	1396.71	J/mol×K	1229.47	Joback Calculated Property

Similar Compounds

Find more compounds similar to Succinic acid, 2-fluorophenethyl pentadecyl ester.

Sources

• 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.