Chemical Properties of Succinic acid, cyclohexylmethyl 3-hexyl ester

InChI

InChI=1S/C17H30O4/c1-3-8-15(4-2)21-17(19)12-11-16(18)20-13-14-9-6-5-7-10-14/h14-15H,3-13H2,1-2H3

InChI Key

RBWOZNUDQLQIGM-UHFFFAOYSA-N

Formula

C17H30O4

SMILES

CCCC(CC)OC(=O)CCC(=O)OCC1CCCCC1

Molecular Weight¹

298.42

• C_p,gas : Ideal gas heat capacity (J/mol×K).
• η : Dynamic viscosity (Pa×s).
• Δ_fusH° : Enthalpy of fusion at standard conditions (kJ/mol).
• Δ_vapH° : Enthalpy of vaporization at standard conditions (kJ/mol).
• 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°	36.84	kJ/mol	Joback Calculated Property
ΔvapH°	88.35	kJ/mol	Relay (1.0) Calculated Property
logPoct/wat	4.012		Crippen Calculated Property
McVol	254.410	ml/mol	McGowan Calculated Property
Inp	[2051.00; 2051.00]
Inp	2051.00		NIST
Inp	2051.00		NIST
Tboil	615.33	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, Standard Gibbs free energy of formation, Acentric Factor, Ionization energy, 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	[771.79; 869.48]	J/mol×K	[724.11; 917.50]
Cp,gas	771.79	J/mol×K	724.11	Joback Calculated Property
Cp,gas	791.13	J/mol×K	756.34	Joback Calculated Property
Cp,gas	809.23	J/mol×K	788.57	Joback Calculated Property
Cp,gas	826.10	J/mol×K	820.81	Joback Calculated Property
Cp,gas	841.75	J/mol×K	853.04	Joback Calculated Property
Cp,gas	856.20	J/mol×K	885.27	Joback Calculated Property
Cp,gas	869.48	J/mol×K	917.50	Joback Calculated Property
η	[0.0000625; 0.0034834]	Pa×s	[358.39; 724.11]
η	0.0034834	Pa×s	358.39	Joback Calculated Property
η	0.0010953	Pa×s	419.34	Joback Calculated Property
η	0.0004619	Pa×s	480.30	Joback Calculated Property
η	0.0002366	Pa×s	541.25	Joback Calculated Property
η	0.0001388	Pa×s	602.20	Joback Calculated Property
η	0.0000898	Pa×s	663.16	Joback Calculated Property
η	0.0000625	Pa×s	724.11	Joback Calculated Property

Similar Compounds

Find more compounds similar to Succinic acid, cyclohexylmethyl 3-hexyl 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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