Chemical Properties of p-Mentha-2,6-dien-8-ol, acetate

InChI

InChI=1S/C12H18O2/c1-9-5-7-11(8-6-9)12(3,4)14-10(2)13/h5-7,11H,8H2,1-4H3

InChI Key

MOWPKBJNIRETRJ-UHFFFAOYSA-N

Formula

C12H18O2

SMILES

CC(=O)OC(C)(C)C1C=CC(C)=CC1

Molecular Weight¹

194.27

Other Names

• p-Mentha-2,6-dien-8-yl, acetate

• 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).
• logP_oct/wat : Octanol/Water partition coefficient.
• McVol : McGowan's characteristic volume (ml/mol).
• I_np : Non-polar retention indices.
• ¹: Molecular weight from the IUPAC atomic weights tables.

Physical Properties

Property	Value	Unit	Source
ΔfusH°	17.68	kJ/mol	Joback Calculated Property
logPoct/wat	2.850		Crippen Calculated Property
McVol	167.920	ml/mol	McGowan Calculated Property
Inp	[1292.00; 1292.00]
Inp	1292.00		NIST
Inp	1292.00		NIST
Inp	1292.00		NIST

Cheméo can also estimate Normal Boiling Point Temperature, 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.

Correlations

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[226.41; 567.43]	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			-4.28300e+01
Coefficient B			1.16548e+00
Coefficient C			-6.94720e-04
Coefficient D			1.39500e-07
Coefficient E			0.00000e+00
Temperature range, min.			273.00
Temperature range, max.			1000.00
Cp,gas	226.41	J/mol×K	273.00	Calculated Property
Cp,gas	288.72	J/mol×K	353.78	Calculated Property
Cp,gas	343.89	J/mol×K	434.56	Calculated Property
Cp,gas	392.38	J/mol×K	515.33	Calculated Property
Cp,gas	434.61	J/mol×K	596.11	Calculated Property
Cp,gas	471.03	J/mol×K	676.89	Calculated Property
Cp,gas	502.08	J/mol×K	757.67	Calculated Property
Cp,gas	528.20	J/mol×K	838.44	Calculated Property
Cp,gas	549.84	J/mol×K	919.22	Calculated Property
Cp,gas	567.43	J/mol×K	1000.00	Calculated Property

Property	Value	Unit	Temperature (K)	Source
η	[0.0040690; 0.0001900]	Pa×s	[291.17; 536.23]	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			-1.22087e+01
Coefficient B			1.95211e+03
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.			291.17
Temperature range, max.			536.23
η	0.0040690	Pa×s	291.17	Calculated Property
η	0.0022934	Pa×s	318.40	Calculated Property
η	0.0014149	Pa×s	345.63	Calculated Property
η	0.0009367	Pa×s	372.86	Calculated Property
η	0.0006559	Pa×s	400.09	Calculated Property
η	0.0004806	Pa×s	427.32	Calculated Property
η	0.0003656	Pa×s	454.55	Calculated Property
η	0.0002868	Pa×s	481.77	Calculated Property
η	0.0002309	Pa×s	509.00	Calculated Property
η	0.0001900	Pa×s	536.23	Calculated Property

Similar Compounds

Find more compounds similar to p-Mentha-2,6-dien-8-ol, acetate.

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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