Chemical Properties of Cyclohexanecarboxylic acid, decyl ester (CAS 93479-48-2)

InChI

InChI=1S/C17H32O2/c1-2-3-4-5-6-7-8-12-15-19-17(18)16-13-10-9-11-14-16/h16H,2-15H2,1H3

InChI Key

MOZHOBFQUILDKL-UHFFFAOYSA-N

Formula

C17H32O2

SMILES

CCCCCCCCCCOC(=O)C1CCCCC1

Molecular Weight¹

268.43

CAS

93479-48-2

Other Names

• decyl cyclohexanecarboxylate

• ω : Acentric Factor.
• 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).
• V_c : Critical Volume (m³/kmol).
• ¹: Molecular weight from the IUPAC atomic weights tables.

Physical Properties

Property	Value	Unit	Source
ω	0.7537		Relay (1.0) Calculated Property
ΔfH°gas	-651.65	kJ/mol	Relay (1.0) Calculated Property
ΔfusH°	35.99	kJ/mol	Joback Calculated Property
ΔvapH°	83.74	kJ/mol	Relay (1.0) Calculated Property
log10WS	-5.63		Relay (1.0) Calculated Property
logPoct/wat	5.251		Crippen Calculated Property
McVol	246.970	ml/mol	McGowan Calculated Property
Pc	1434.80	kPa	Joback Calculated Property
Inp	[1905.95; 1909.72]
Inp	1905.95		NIST
Inp	1909.72		NIST
Tboil	593.93	K	Relay (1.0) Calculated Property
Tc	798.70	K	Relay (1.0) Calculated Property
Tfus	282.30	K	Relay (1.0) Calculated Property
Vc	0.928	m3/kmol	Relay (1.0) Calculated Property

Cheméo can also estimate Standard Gibbs free energy of formation, 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	[719.23; 828.78]	J/mol×K	[666.33; 852.67]
Cp,gas	719.23	J/mol×K	666.33	Joback Calculated Property
Cp,gas	740.24	J/mol×K	697.39	Joback Calculated Property
Cp,gas	760.11	J/mol×K	728.44	Joback Calculated Property
Cp,gas	778.87	J/mol×K	759.50	Joback Calculated Property
Cp,gas	796.56	J/mol×K	790.56	Joback Calculated Property
Cp,gas	813.18	J/mol×K	821.61	Joback Calculated Property
Cp,gas	828.78	J/mol×K	852.67	Joback Calculated Property
η	[0.0001026; 0.0040910]	Pa×s	[331.06; 666.33]
η	0.0040910	Pa×s	331.06	Joback Calculated Property
η	0.0014204	Pa×s	386.94	Joback Calculated Property
η	0.0006441	Pa×s	442.82	Joback Calculated Property
η	0.0003487	Pa×s	498.69	Joback Calculated Property
η	0.0002136	Pa×s	554.57	Joback Calculated Property
η	0.0001431	Pa×s	610.45	Joback Calculated Property
η	0.0001026	Pa×s	666.33	Joback Calculated Property

Similar Compounds

Find more compounds similar to Cyclohexanecarboxylic acid, decyl ester.

Sources

• Cheméo Relay (1.0)
• Crippen Method
• Crippen Method
• Joback Method
• McGowan Method
• NIST Webbook

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