Chemical Properties of Succinic acid, 2-ethylhexyl neopentyl ester

InChI

InChI=1S/C17H32O4/c1-6-8-9-14(7-2)12-20-15(18)10-11-16(19)21-13-17(3,4)5/h14H,6-13H2,1-5H3

InChI Key

YIUPDCJJJQJZMB-UHFFFAOYSA-N

Formula

C17H32O4

SMILES

CCCCC(CC)COC(=O)CCC(=O)OCC(C)(C)C

Molecular Weight¹

300.43

• 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).
• 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).
• ¹: Molecular weight from the IUPAC atomic weights tables.

Physical Properties

Property	Value	Unit	Source
ΔfH°gas	-1039.92	kJ/mol	Relay (1.0) Calculated Property
ΔfusH°	37.59	kJ/mol	Joback Calculated Property
ΔvapH°	82.00	kJ/mol	Relay (1.0) Calculated Property
log10WS	-4.59		Relay (1.0) Calculated Property
logPoct/wat	4.115		Crippen Calculated Property
McVol	265.270	ml/mol	McGowan Calculated Property
Pc	1263.75	kPa	Joback Calculated Property
Inp	[1863.00; 1863.00]
Inp	1863.00		NIST
Inp	1863.00		NIST
Tboil	583.28	K	Relay (1.0) Calculated Property
Tc	743.68	K	Relay (1.0) Calculated Property
Tfus	243.89	K	Relay (1.0) Calculated Property

Cheméo can also estimate 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	[777.95; 870.59]	J/mol×K	[701.33; 880.20]
Cp,gas	777.95	J/mol×K	701.33	Joback Calculated Property
Cp,gas	795.81	J/mol×K	731.14	Joback Calculated Property
Cp,gas	812.67	J/mol×K	760.95	Joback Calculated Property
Cp,gas	828.55	J/mol×K	790.77	Joback Calculated Property
Cp,gas	843.48	J/mol×K	820.58	Joback Calculated Property
Cp,gas	857.49	J/mol×K	850.39	Joback Calculated Property
Cp,gas	870.59	J/mol×K	880.20	Joback Calculated Property
η	[0.0000508; 0.0032753]	Pa×s	[353.43; 701.33]
η	0.0032753	Pa×s	353.43	Joback Calculated Property
η	0.0010025	Pa×s	411.41	Joback Calculated Property
η	0.0004111	Pa×s	469.40	Joback Calculated Property
η	0.0002051	Pa×s	527.38	Joback Calculated Property
η	0.0001174	Pa×s	585.36	Joback Calculated Property
η	0.0000743	Pa×s	643.35	Joback Calculated Property
η	0.0000508	Pa×s	701.33	Joback Calculated Property

Similar Compounds

Find more compounds similar to Succinic acid, 2-ethylhexyl neopentyl ester.

Sources

• Cheméo Relay (1.0)
• 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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