Chemical Properties of Succinic acid, hept-2-yl tetradec-3-en-1-yl ester

InChI

InChI=1S/C25H46O4/c1-4-6-8-9-10-11-12-13-14-15-16-18-22-28-24(26)20-21-25(27)29-23(3)19-17-7-5-2/h15-16,23H,4-14,17-22H2,1-3H3/b16-15+

InChI Key

PVUHSBFFPVTQSO-FOCLMDBBSA-N

Formula

C25H46O4

SMILES

CCCCCCCCCC/C=C/CCOC(=O)CCC(=O)OC(C)CCCCC

Molecular Weight¹

410.64

• C_p,gas : Ideal gas heat capacity (J/mol×K).
• η : Dynamic viscosity (Pa×s).
• 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).
• 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).
• ¹: Molecular weight from the IUPAC atomic weights tables.

Physical Properties

Property	Value	Unit	Source
ΔfH°gas	-1085.24	kJ/mol	Relay (1.0) Calculated Property
ΔfusH°	65.92	kJ/mol	Joback Calculated Property
ΔvapH°	118.42	kJ/mol	Relay (1.0) Calculated Property
log10WS	-6.63		Relay (1.0) Calculated Property
logPoct/wat	7.299		Crippen Calculated Property
McVol	373.690	ml/mol	McGowan Calculated Property
Inp	[2776.00; 2776.00]
Inp	2776.00		NIST
Inp	2776.00		NIST
Tboil	633.30	K	Relay (1.0) Calculated Property
Tc	823.07	K	Relay (1.0) Calculated Property
Tfus	265.98	K	Relay (1.0) Calculated Property

Cheméo can also estimate Critical Pressure, Critical Volume, 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	[1235.83; 1335.21]	J/mol×K	[891.76; 1092.27]
Cp,gas	1235.83	J/mol×K	891.76	Joback Calculated Property
Cp,gas	1255.73	J/mol×K	925.18	Joback Calculated Property
Cp,gas	1274.23	J/mol×K	958.60	Joback Calculated Property
Cp,gas	1291.37	J/mol×K	992.02	Joback Calculated Property
Cp,gas	1307.22	J/mol×K	1025.44	Joback Calculated Property
Cp,gas	1321.82	J/mol×K	1058.85	Joback Calculated Property
Cp,gas	1335.21	J/mol×K	1092.27	Joback Calculated Property
η	[0.0000155; 0.0008904]	Pa×s	[436.09; 891.76]
η	0.0008904	Pa×s	436.09	Joback Calculated Property
η	0.0002747	Pa×s	512.04	Joback Calculated Property
η	0.0001148	Pa×s	587.98	Joback Calculated Property
η	0.0000586	Pa×s	663.92	Joback Calculated Property
η	0.0000343	Pa×s	739.87	Joback Calculated Property
η	0.0000222	Pa×s	815.82	Joback Calculated Property
η	0.0000155	Pa×s	891.76	Joback Calculated Property

Similar Compounds

Find more compounds similar to Succinic acid, hept-2-yl tetradec-3-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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