Chemical Properties of 3,4-Dihydro-2H-pyran, 3-isopropyl-6-methyl-2-(3-methylcyclopent-2-enyl)

InChI

InChI=1S/C15H24O/c1-10(2)14-8-6-12(4)16-15(14)13-7-5-11(3)9-13/h6,9-10,13-15H,5,7-8H2,1-4H3

InChI Key

GUDFQPBIOYFJEG-UHFFFAOYSA-N

Formula

C15H24O

SMILES

CC1=CC(C2OC(C)=CCC2C(C)C)CC1

Molecular Weight¹

220.35

• 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.
• I : Polar retention indices.
• ¹: Molecular weight from the IUPAC atomic weights tables.

Physical Properties

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	[263.81; 719.60]	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			-7.11000e+01
Coefficient B			1.42808e+00
Coefficient C			-7.74980e-04
Coefficient D			1.37600e-07
Coefficient E			0.00000e+00
Temperature range, min.			273.00
Temperature range, max.			1000.00
Cp,gas	263.81	J/mol×K	273.00	Calculated Property
Cp,gas	343.22	J/mol×K	353.78	Calculated Property
Cp,gas	414.43	J/mol×K	434.56	Calculated Property
Cp,gas	477.86	J/mol×K	515.33	Calculated Property
Cp,gas	533.95	J/mol×K	596.11	Calculated Property
Cp,gas	583.15	J/mol×K	676.89	Calculated Property
Cp,gas	625.87	J/mol×K	757.67	Calculated Property
Cp,gas	662.57	J/mol×K	838.44	Calculated Property
Cp,gas	693.66	J/mol×K	919.22	Calculated Property
Cp,gas	719.60	J/mol×K	1000.00	Calculated Property

Property	Value	Unit	Temperature (K)	Source
η	[0.0027190; 0.0002988]	Pa×s	[310.98; 579.84]	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			-1.06698e+01
Coefficient B			1.48097e+03
Coefficient C			0.00000e+00
Coefficient D			0.00000e+00
Coefficient E			0.00000e+00
Temperature range, min.			310.98
Temperature range, max.			579.84
η	0.0027190	Pa×s	310.98	Calculated Property
η	0.0017912	Pa×s	340.85	Calculated Property
η	0.0012621	Pa×s	370.73	Calculated Property
η	0.0009369	Pa×s	400.60	Calculated Property
η	0.0007249	Pa×s	430.47	Calculated Property
η	0.0005799	Pa×s	460.35	Calculated Property
η	0.0004766	Pa×s	490.22	Calculated Property
η	0.0004007	Pa×s	520.10	Calculated Property
η	0.0003433	Pa×s	549.97	Calculated Property
η	0.0002988	Pa×s	579.84	Calculated Property

Similar Compounds

Find more compounds similar to 3,4-Dihydro-2H-pyran, 3-isopropyl-6-methyl-2-(3-methylcyclopent-2-enyl).

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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