Chemical Properties of Succinic acid, 2,2-dimethylpent-3-yl isobutyl ester

InChI

InChI=1S/C15H28O4/c1-7-12(15(4,5)6)19-14(17)9-8-13(16)18-10-11(2)3/h11-12H,7-10H2,1-6H3

InChI Key

JEASZTJVUXRRHU-UHFFFAOYSA-N

Formula

C15H28O4

SMILES

CCC(OC(=O)CCC(=O)OCC(C)C)C(C)(C)C

Molecular Weight¹

272.38

• 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).
• IE : Ionization energy (eV).
• 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	-1005.69	kJ/mol	Relay (1.0) Calculated Property
ΔfusH°	28.88	kJ/mol	Joback Calculated Property
ΔvapH°	74.55	kJ/mol	Relay (1.0) Calculated Property
IE	9.56	eV	Relay (1.0) Calculated Property
logPoct/wat	3.334		Crippen Calculated Property
McVol	237.090	ml/mol	McGowan Calculated Property
Pc	1464.61	kPa	Joback Calculated Property
Inp	[1647.00; 1647.00]
Inp	1647.00		NIST
Inp	1647.00		NIST
Tboil	551.14	K	Relay (1.0) Calculated Property
Tc	721.09	K	Relay (1.0) Calculated Property
Tfus	256.95	K	Relay (1.0) Calculated Property

Cheméo can also estimate Critical Volume, Standard Gibbs free energy of formation, Acentric Factor, 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.

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[666.28; 757.42]	J/mol×K	[655.13; 837.78]
Cp,gas	666.28	J/mol×K	655.13	Joback Calculated Property
Cp,gas	683.84	J/mol×K	685.57	Joback Calculated Property
Cp,gas	700.42	J/mol×K	716.01	Joback Calculated Property
Cp,gas	716.05	J/mol×K	746.45	Joback Calculated Property
Cp,gas	730.75	J/mol×K	776.89	Joback Calculated Property
Cp,gas	744.53	J/mol×K	807.34	Joback Calculated Property
Cp,gas	757.42	J/mol×K	837.78	Joback Calculated Property
η	[0.0000642; 0.0065160]	Pa×s	[315.89; 655.13]
η	0.0065160	Pa×s	315.89	Joback Calculated Property
η	0.0016816	Pa×s	372.43	Joback Calculated Property
η	0.0006202	Pa×s	428.97	Joback Calculated Property
η	0.0002886	Pa×s	485.51	Joback Calculated Property
η	0.0001575	Pa×s	542.05	Joback Calculated Property
η	0.0000964	Pa×s	598.59	Joback Calculated Property
η	0.0000642	Pa×s	655.13	Joback Calculated Property

Similar Compounds

Find more compounds similar to Succinic acid, 2,2-dimethylpent-3-yl isobutyl 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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