Chemical Properties of Malonic acid, 2-chloropropyl propyl ester

InChI

InChI=1S/C9H15ClO4/c1-3-4-13-8(11)5-9(12)14-6-7(2)10/h7H,3-6H2,1-2H3

InChI Key

IQLRLUZXLPNYMG-UHFFFAOYSA-N

Formula

C9H15ClO4

SMILES

CCCOC(=O)CC(=O)OCC(C)Cl

Molecular Weight¹

222.67

• 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).
• P_c : Critical Pressure (kPa).
• I_np : Non-polar retention indices.
• 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 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	[242.17; 508.67]	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			5.67340e+01
Coefficient B			7.61940e-01
Coefficient C			-3.00200e-04
Coefficient D			-9.80000e-09
Coefficient E			0.00000e+00
Temperature range, min.			273.00
Temperature range, max.			1000.00
Cp,gas	242.17	J/mol×K	273.00	Calculated Property
Cp,gas	288.28	J/mol×K	353.78	Calculated Property
Cp,gas	330.35	J/mol×K	434.56	Calculated Property
Cp,gas	368.32	J/mol×K	515.33	Calculated Property
Cp,gas	402.18	J/mol×K	596.11	Calculated Property
Cp,gas	431.90	J/mol×K	676.89	Calculated Property
Cp,gas	457.44	J/mol×K	757.67	Calculated Property
Cp,gas	478.76	J/mol×K	838.44	Calculated Property
Cp,gas	495.85	J/mol×K	919.22	Calculated Property
Cp,gas	508.67	J/mol×K	1000.00	Calculated Property

Property	Value	Unit	Temperature (K)	Source
η	[0.0054763; 0.0002103]	Pa×s	[290.77; 520.66]	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			-1.25893e+01
Coefficient B			2.14646e+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.			290.77
Temperature range, max.			520.66
η	0.0054763	Pa×s	290.77	Calculated Property
η	0.0030171	Pa×s	316.31	Calculated Property
η	0.0018171	Pa×s	341.86	Calculated Property
η	0.0011744	Pa×s	367.40	Calculated Property
η	0.0008033	Pa×s	392.94	Calculated Property
η	0.0005755	Pa×s	418.49	Calculated Property
η	0.0004285	Pa×s	444.03	Calculated Property
η	0.0003294	Pa×s	469.58	Calculated Property
η	0.0002602	Pa×s	495.12	Calculated Property
η	0.0002103	Pa×s	520.66	Calculated Property

Similar Compounds

Find more compounds similar to Malonic acid, 2-chloropropyl propyl ester.

Sources

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

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