Chemical Properties of Cyclopropanecarboxylic acid, trans-2-phenyl-, nonyl ester

InChI

InChI=1S/C19H28O2/c1-2-3-4-5-6-7-11-14-21-19(20)18-15-17(18)16-12-9-8-10-13-16/h8-10,12-13,17-18H,2-7,11,14-15H2,1H3

InChI Key

DDSRIPNWUSPZSS-UHFFFAOYSA-N

Formula

C19H28O2

SMILES

CCCCCCCCCOC(=O)C1CC1c1ccccc1

Molecular Weight¹

288.43

• 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

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.

Correlations

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[346.45; 875.54]	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			-6.71820e+01
Coefficient B			1.79952e+00
Coefficient C			-1.11120e-03
Coefficient D			2.54400e-07
Coefficient E			0.00000e+00
Temperature range, min.			273.00
Temperature range, max.			1000.00
Cp,gas	346.45	J/mol×K	273.00	Calculated Property
Cp,gas	441.64	J/mol×K	353.78	Calculated Property
Cp,gas	525.85	J/mol×K	434.56	Calculated Property
Cp,gas	599.89	J/mol×K	515.33	Calculated Property
Cp,gas	664.56	J/mol×K	596.11	Calculated Property
Cp,gas	720.66	J/mol×K	676.89	Calculated Property
Cp,gas	769.01	J/mol×K	757.67	Calculated Property
Cp,gas	810.40	J/mol×K	838.44	Calculated Property
Cp,gas	845.64	J/mol×K	919.22	Calculated Property
Cp,gas	875.54	J/mol×K	1000.00	Calculated Property

Property	Value	Unit	Temperature (K)	Source
η	[0.0021221; 0.0003440]	Pa×s	[386.34; 643.50]	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			-1.07085e+01
Coefficient B			1.75909e+03
Coefficient C			0.00000e+00
Coefficient D			0.00000e+00
Coefficient E			0.00000e+00
Temperature range, min.			386.34
Temperature range, max.			643.50
η	0.0021221	Pa×s	386.34	Calculated Property
η	0.0015510	Pa×s	414.91	Calculated Property
η	0.0011802	Pa×s	443.49	Calculated Property
η	0.0009283	Pa×s	472.06	Calculated Property
η	0.0007505	Pa×s	500.63	Calculated Property
η	0.0006208	Pa×s	529.21	Calculated Property
η	0.0005236	Pa×s	557.78	Calculated Property
η	0.0004490	Pa×s	586.35	Calculated Property
η	0.0003906	Pa×s	614.93	Calculated Property
η	0.0003440	Pa×s	643.50	Calculated Property

Similar Compounds

Find more compounds similar to Cyclopropanecarboxylic acid, trans-2-phenyl-, nonyl ester.

Sources

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

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