Chemical Properties of Cyclopropaneoctanoic acid, 2-[[2-[(2-ethylcyclopropyl)methyl]cyclopropyl]methyl]-, methyl ester (CAS 10152-71-3)

InChI

InChI=1S/C22H38O2/c1-3-16-11-18(16)13-20-15-21(20)14-19-12-17(19)9-7-5-4-6-8-10-22(23)24-2/h16-21H,3-15H2,1-2H3

InChI Key

KDWSWRXUIMELKF-UHFFFAOYSA-N

Formula

C22H38O2

SMILES

CCC1CC1CC1CC1CC1CC1CCCCCCCC(=O)OC

Molecular Weight¹

334.54

CAS

10152-71-3

• 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).
• 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

Cheméo can also estimate 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.

Correlations

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[424.99; 1121.63]	J/mol×K	[273.00; 1000.00]	Joback Predicted correlation
Equation			Y = A + B·T + C·T² + D·T³ + E·T⁴ Y is Cp,gas in J/mol×K, T in K
Coefficient A			-1.24610e+02
Coefficient B			2.41224e+00
Coefficient C			-1.57280e-03
Coefficient D			4.06800e-07
Coefficient E			0.00000e+00
Temperature range, min.			273.00
Temperature range, max.			1000.00
Cp,gas	424.99	J/mol×K	273.00	Calculated Property
Cp,gas	549.95	J/mol×K	353.78	Calculated Property
Cp,gas	660.02	J/mol×K	434.56	Calculated Property
Cp,gas	756.48	J/mol×K	515.33	Calculated Property
Cp,gas	840.63	J/mol×K	596.11	Calculated Property
Cp,gas	913.75	J/mol×K	676.89	Calculated Property
Cp,gas	977.12	J/mol×K	757.67	Calculated Property
Cp,gas	1032.03	J/mol×K	838.44	Calculated Property
Cp,gas	1079.77	J/mol×K	919.22	Calculated Property
Cp,gas	1121.63	J/mol×K	1000.00	Calculated Property

Property	Value	Unit	Temperature (K)	Source
η	[0.0039705; 0.0026023]	Pa×s	[421.13; 668.28]	Joback Predicted correlation
Equation			Y = exp(A + B/T + C·ln(T) + D·T^E) Y is η in Pa×s, T in K
Coefficient A			-6.67123e+00
Coefficient B			4.81090e+02
Coefficient C			0.00000e+00
Coefficient D			0.00000e+00
Coefficient E			0.00000e+00
Comment			Liquid phase. Joback/Reid (1987), valid from Tf to 0.7·Tc.
Temperature range, min.			421.13
Temperature range, max.			668.28
η	0.0039705	Pa×s	421.13	Calculated Property
η	0.0037024	Pa×s	448.59	Calculated Property
η	0.0034803	Pa×s	476.05	Calculated Property
η	0.0032936	Pa×s	503.51	Calculated Property
η	0.0031348	Pa×s	530.98	Calculated Property
η	0.0029982	Pa×s	558.44	Calculated Property
η	0.0028796	Pa×s	585.90	Calculated Property
η	0.0027756	Pa×s	613.36	Calculated Property
η	0.0026839	Pa×s	640.82	Calculated Property
η	0.0026023	Pa×s	668.28	Calculated Property

Similar Compounds

Find more compounds similar to Cyclopropaneoctanoic acid, 2-[[2-[(2-ethylcyclopropyl)methyl]cyclopropyl]methyl]-, methyl 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.
Calculated This icon marks a calculated value or equation: a prediction, not a measurement.
These property values are available through the Cheméo API. A free account gives you an access key.