Chemical Properties of Benzoic acid, (-)-menthyl ester

InChI

InChI=1S/C17H24O2/c1-12(2)15-10-9-13(3)11-16(15)19-17(18)14-7-5-4-6-8-14/h4-8,12-13,15-16H,9-11H2,1-3H3

InChI Key

TTYVYRHNIVBWCB-UHFFFAOYSA-N

Formula

C17H24O2

SMILES

CC1CCC(C(C)C)C(OC(=O)c2ccccc2)C1

Molecular Weight¹

260.38

Other Names

• (-)-menthyl benzoate
• Menthyl benzoate

• 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 a given temperature (kJ/mol).
• logP_oct/wat : Octanol/Water partition coefficient.
• McVol : McGowan's characteristic volume (ml/mol).
• T_boil : Normal Boiling Point Temperature (K).
• ¹: Molecular weight from the IUPAC atomic weights tables.

Physical Properties

Cheméo can also estimate Normal melting (fusion) point, Critical Temperature, Critical Pressure, Critical Volume, Enthalpy of formation at standard conditions, Enthalpy of vaporization 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

Correlations

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[291.29; 784.89]	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			-7.64700e+01
Coefficient B			1.56016e+00
Coefficient C			-8.11000e-04
Coefficient D			1.12200e-07
Coefficient E			0.00000e+00
Temperature range, min.			273.00
Temperature range, max.			1000.00
Cp,gas	291.29	J/mol×K	273.00	Calculated Property
Cp,gas	378.94	J/mol×K	353.78	Calculated Property
Cp,gas	457.57	J/mol×K	434.56	Calculated Property
Cp,gas	527.51	J/mol×K	515.33	Calculated Property
Cp,gas	589.14	J/mol×K	596.11	Calculated Property
Cp,gas	642.80	J/mol×K	676.89	Calculated Property
Cp,gas	688.85	J/mol×K	757.67	Calculated Property
Cp,gas	727.65	J/mol×K	838.44	Calculated Property
Cp,gas	759.54	J/mol×K	919.22	Calculated Property
Cp,gas	784.89	J/mol×K	1000.00	Calculated Property

Property	Value	Unit	Temperature (K)	Source
η	[0.0029563; 0.0001722]	Pa×s	[334.00; 635.65]	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			-1.18149e+01
Coefficient B			2.00101e+03
Coefficient C			0.00000e+00
Coefficient D			0.00000e+00
Coefficient E			0.00000e+00
Temperature range, min.			334.00
Temperature range, max.			635.65
η	0.0029563	Pa×s	334.00	Calculated Property
η	0.0017118	Pa×s	367.52	Calculated Property
η	0.0010860	Pa×s	401.03	Calculated Property
η	0.0007391	Pa×s	434.55	Calculated Property
η	0.0005315	Pa×s	468.07	Calculated Property
η	0.0003994	Pa×s	501.59	Calculated Property
η	0.0003111	Pa×s	535.10	Calculated Property
η	0.0002496	Pa×s	568.62	Calculated Property
η	0.0002052	Pa×s	602.14	Calculated Property
η	0.0001722	Pa×s	635.65	Calculated Property

Similar Compounds

Find more compounds similar to Benzoic acid, (-)-menthyl 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

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