Chemical Properties of 3-Chloro-4-methoxytoluene

InChI

InChI=1S/C8H9ClO/c1-6-3-4-8(10-2)7(9)5-6/h3-5H,1-2H3

InChI Key

VUZBRBKYGIQXMP-UHFFFAOYSA-N

Formula

C8H9ClO

SMILES

COc1ccc(C)cc1Cl

Molecular Weight¹

156.61

• 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).
• 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 Pressure, 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	[151.85; 334.22]	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			2.87000e+01
Coefficient B			5.09540e-01
Coefficient C			-2.17920e-04
Coefficient D			1.39000e-08
Coefficient E			0.00000e+00
Temperature range, min.			273.00
Temperature range, max.			1000.00
Cp,gas	151.85	J/mol×K	273.00	Calculated Property
Cp,gas	182.30	J/mol×K	353.78	Calculated Property
Cp,gas	210.11	J/mol×K	434.56	Calculated Property
Cp,gas	235.31	J/mol×K	515.33	Calculated Property
Cp,gas	257.95	J/mol×K	596.11	Calculated Property
Cp,gas	278.07	J/mol×K	676.89	Calculated Property
Cp,gas	295.71	J/mol×K	757.67	Calculated Property
Cp,gas	310.92	J/mol×K	838.44	Calculated Property
Cp,gas	323.74	J/mol×K	919.22	Calculated Property
Cp,gas	334.22	J/mol×K	1000.00	Calculated Property

Property	Value	Unit	Temperature (K)	Source
η	[0.0013423; 0.0002003]	Pa×s	[283.53; 487.79]	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			-1.11562e+01
Coefficient B			1.28803e+03
Coefficient C			0.00000e+00
Coefficient D			0.00000e+00
Coefficient E			0.00000e+00
Temperature range, min.			283.53
Temperature range, max.			487.79
η	0.0013423	Pa×s	283.53	Calculated Property
η	0.0009586	Pa×s	306.23	Calculated Property
η	0.0007171	Pa×s	328.92	Calculated Property
η	0.0005569	Pa×s	351.62	Calculated Property
η	0.0004460	Pa×s	374.31	Calculated Property
η	0.0003664	Pa×s	397.01	Calculated Property
η	0.0003074	Pa×s	419.71	Calculated Property
η	0.0002626	Pa×s	442.40	Calculated Property
η	0.0002278	Pa×s	465.10	Calculated Property
η	0.0002003	Pa×s	487.79	Calculated Property

Similar Compounds

Find more compounds similar to 3-Chloro-4-methoxytoluene.

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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