Chemical Properties of Oxalic acid, dicyclohexyl ester (CAS 620-82-6)

InChI

InChI=1S/C14H22O4/c15-13(17-11-7-3-1-4-8-11)14(16)18-12-9-5-2-6-10-12/h11-12H,1-10H2

InChI Key

YJZRTAHDRCUJQT-UHFFFAOYSA-N

Formula

C14H22O4

SMILES

O=C(OC1CCCCC1)C(=O)OC1CCCCC1

Molecular Weight¹

254.32

CAS

620-82-6

Other Names

• Dicyclohexyl oxalate
• Ethanedioic acid, dicyclohexyl ester

• 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).
• 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_fus : Normal melting (fusion) point (K).
• ¹: Molecular weight from the IUPAC atomic weights tables.

Physical Properties

Property	Value	Unit	Source
ΔfH°gas	-848.20	kJ/mol	Relay (1.0) Calculated Property
ΔfusH°	24.42	kJ/mol	Joback Calculated Property
ΔvapH°	92.10 ± 0.70	kJ/mol	NIST
IE	9.47	eV	Relay (1.0) Calculated Property
log10WS	-3.73		Relay (1.0) Calculated Property
logPoct/wat	2.738		Crippen Calculated Property
McVol	201.280	ml/mol	McGowan Calculated Property
Inp	[1846.00; 1880.00]
Inp	1880.00		NIST
Inp	1846.00		NIST
Inp	1853.00		NIST
Inp	1860.00		NIST
Inp	1866.00		NIST
Inp	1880.00		NIST
Inp	1846.00		NIST
Inp	1853.00		NIST
Inp	1860.00		NIST
Inp	1866.00		NIST
Inp	1880.00		NIST
Tboil	595.00	K	Relay (1.0) Calculated Property
Tfus	313.55	K	Relay (1.0) Calculated Property

Cheméo can also estimate Critical Temperature, Critical Pressure, Critical Volume, Standard Gibbs free energy of formation, Acentric Factor 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	[596.02; 700.70]	J/mol×K	[675.46; 902.76]
Cp,gas	596.02	J/mol×K	675.46	Joback Calculated Property
Cp,gas	617.57	J/mol×K	713.34	Joback Calculated Property
Cp,gas	637.46	J/mol×K	751.23	Joback Calculated Property
Cp,gas	655.69	J/mol×K	789.11	Joback Calculated Property
Cp,gas	672.30	J/mol×K	826.99	Joback Calculated Property
Cp,gas	687.29	J/mol×K	864.88	Joback Calculated Property
Cp,gas	700.70	J/mol×K	902.76	Joback Calculated Property
η	[0.0001073; 0.0044430]	Pa×s	[346.96; 675.46]
η	0.0044430	Pa×s	346.96	Joback Calculated Property
η	0.0015648	Pa×s	401.71	Joback Calculated Property
η	0.0007079	Pa×s	456.46	Joback Calculated Property
η	0.0003795	Pa×s	511.21	Joback Calculated Property
η	0.0002296	Pa×s	565.96	Joback Calculated Property
η	0.0001517	Pa×s	620.71	Joback Calculated Property
η	0.0001073	Pa×s	675.46	Joback Calculated Property

Similar Compounds

Find more compounds similar to Oxalic acid, dicyclohexyl 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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