Chemical Properties of 2-Hydroxy-1-methylpropyl (2,4-dichlorophenoxy)acetate

InChI

InChI=1S/C12H14Cl2O4/c1-7(15)8(2)18-12(16)6-17-11-4-3-9(13)5-10(11)14/h3-5,7-8,15H,6H2,1-2H3

InChI Key

VXSLRAHUUHDTDM-UHFFFAOYSA-N

Formula

C12H14Cl2O4

SMILES

CC(O)C(C)OC(=O)COc1ccc(Cl)cc1Cl

Molecular Weight¹

293.15

• 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).
• 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_fus : Normal melting (fusion) point (K).
• ¹: Molecular weight from the IUPAC atomic weights tables.

Physical Properties

Cheméo can also estimate 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 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	[278.32; 576.71]	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			6.52910e+01
Coefficient B			8.87340e-01
Coefficient C			-3.98120e-04
Coefficient D			2.22000e-08
Coefficient E			0.00000e+00
Temperature range, min.			273.00
Temperature range, max.			1000.00
Cp,gas	278.32	J/mol×K	273.00	Calculated Property
Cp,gas	330.37	J/mol×K	353.78	Calculated Property
Cp,gas	377.53	J/mol×K	434.56	Calculated Property
Cp,gas	419.88	J/mol×K	515.33	Calculated Property
Cp,gas	457.48	J/mol×K	596.11	Calculated Property
Cp,gas	490.40	J/mol×K	676.89	Calculated Property
Cp,gas	518.71	J/mol×K	757.67	Calculated Property
Cp,gas	542.49	J/mol×K	838.44	Calculated Property
Cp,gas	561.80	J/mol×K	919.22	Calculated Property
Cp,gas	576.71	J/mol×K	1000.00	Calculated Property

Property	Value	Unit	Temperature (K)	Source
η	[0.0010315; 0.0000360]	Pa×s	[431.68; 674.58]	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			-1.61913e+01
Coefficient B			4.02094e+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.			431.68
Temperature range, max.			674.58
η	0.0010315	Pa×s	431.68	Calculated Property
η	0.0005963	Pa×s	458.67	Calculated Property
η	0.0003663	Pa×s	485.66	Calculated Property
η	0.0002369	Pa×s	512.65	Calculated Property
η	0.0001600	Pa×s	539.64	Calculated Property
η	0.0001122	Pa×s	566.63	Calculated Property
η	0.0000813	Pa×s	593.61	Calculated Property
η	0.0000605	Pa×s	620.60	Calculated Property
η	0.0000462	Pa×s	647.59	Calculated Property
η	0.0000360	Pa×s	674.58	Calculated Property

Similar Compounds

Find more compounds similar to 2-Hydroxy-1-methylpropyl (2,4-dichlorophenoxy)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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