Chemical Properties of 1-(1-Methoxypropan-2-yloxy)propan-2-yl 2-chlorobenzoate

InChI

InChI=1S/C14H19ClO4/c1-10(8-17-3)18-9-11(2)19-14(16)12-6-4-5-7-13(12)15/h4-7,10-11H,8-9H2,1-3H3

InChI Key

FTYAATMEBXYHFJ-UHFFFAOYSA-N

Formula

C14H19ClO4

SMILES

COCC(C)OCC(C)OC(=O)c1ccccc1Cl

Molecular Weight¹

286.75

• 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).
• P_c : Critical Pressure (kPa).
• I_np : Non-polar retention indices.
• T_boil : Normal Boiling Point Temperature (K).
• T_c : Critical Temperature (K).
• ¹: Molecular weight from the IUPAC atomic weights tables.

Physical Properties

Cheméo can also estimate Normal melting (fusion) point, 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	[307.69; 674.49]	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			5.64920e+01
Coefficient B			1.03286e+00
Coefficient C			-4.12160e-04
Coefficient D			-2.70000e-09
Coefficient E			0.00000e+00
Temperature range, min.			273.00
Temperature range, max.			1000.00
Cp,gas	307.69	J/mol×K	273.00	Calculated Property
Cp,gas	370.19	J/mol×K	353.78	Calculated Property
Cp,gas	427.27	J/mol×K	434.56	Calculated Property
Cp,gas	478.93	J/mol×K	515.33	Calculated Property
Cp,gas	525.16	J/mol×K	596.11	Calculated Property
Cp,gas	565.94	J/mol×K	676.89	Calculated Property
Cp,gas	601.28	J/mol×K	757.67	Calculated Property
Cp,gas	631.15	J/mol×K	838.44	Calculated Property
Cp,gas	655.56	J/mol×K	919.22	Calculated Property
Cp,gas	674.49	J/mol×K	1000.00	Calculated Property

Property	Value	Unit	Temperature (K)	Source
η	[0.0013828; 0.0000920]	Pa×s	[373.19; 628.23]	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			-1.32604e+01
Coefficient B			2.49170e+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.			373.19
Temperature range, max.			628.23
η	0.0013828	Pa×s	373.19	Calculated Property
η	0.0008632	Pa×s	401.53	Calculated Property
η	0.0005734	Pa×s	429.87	Calculated Property
η	0.0004007	Pa×s	458.20	Calculated Property
η	0.0002919	Pa×s	486.54	Calculated Property
η	0.0002202	Pa×s	514.88	Calculated Property
η	0.0001711	Pa×s	543.22	Calculated Property
η	0.0001363	Pa×s	571.56	Calculated Property
η	0.0001109	Pa×s	599.89	Calculated Property
η	0.0000920	Pa×s	628.23	Calculated Property

Similar Compounds

Find more compounds similar to 1-(1-Methoxypropan-2-yloxy)propan-2-yl 2-chlorobenzoate.

Sources

• Cheméo Relay (1.0)
• Crippen Method
• Crippen Method
• Joback Method
• McGowan Method
• NIST Webbook

Note: Cheméo is only indexing the data, follow the source links to retrieve the latest data. The source is also providing more information like the publication year, authors and more. Take the time to validate and double check the source of the data.
Calculated This icon marks a calculated value or equation: a prediction, not a measurement.
These property values are available through the Cheméo API. A free account gives you an access key.