Chemical Properties of Cyclopropane-1,2-dicarboxylic acid dimethyl ester, E

InChI

InChI=1S/C7H10O4/c1-10-6(8)4-3-5(4)7(9)11-2/h4-5H,3H2,1-2H3/t4-,5-/m0/s1

InChI Key

JBVOSZYUSFDYIN-WHFBIAKZSA-N

Formula

C7H10O4

SMILES

COC(=O)C1CC1C(=O)OC

Molecular Weight¹

158.15

• 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).
• log₁₀WS : Log10 of Water solubility in mol/l.
• logP_oct/wat : Octanol/Water partition coefficient.
• McVol : McGowan's characteristic volume (ml/mol).
• I_np : Non-polar retention indices.
• T_boil : Normal Boiling Point Temperature (K).
• ¹: Molecular weight from the IUPAC atomic weights tables.

Physical Properties

Cheméo can also estimate Normal melting (fusion) point, Critical Temperature, Critical Pressure, Critical Volume, Standard Gibbs free energy of formation, Acentric Factor, Ionization energy 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	[165.48; 383.08]	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			3.04000e+00
Coefficient B			6.83640e-01
Coefficient C			-3.32600e-04
Coefficient D			2.90000e-08
Coefficient E			0.00000e+00
Temperature range, min.			273.00
Temperature range, max.			1000.00
Cp,gas	165.48	J/mol×K	273.00	Calculated Property
Cp,gas	204.55	J/mol×K	353.78	Calculated Property
Cp,gas	239.69	J/mol×K	434.56	Calculated Property
Cp,gas	270.98	J/mol×K	515.33	Calculated Property
Cp,gas	298.52	J/mol×K	596.11	Calculated Property
Cp,gas	322.39	J/mol×K	676.89	Calculated Property
Cp,gas	342.69	J/mol×K	757.67	Calculated Property
Cp,gas	359.51	J/mol×K	838.44	Calculated Property
Cp,gas	372.94	J/mol×K	919.22	Calculated Property
Cp,gas	383.08	J/mol×K	1000.00	Calculated Property

Property	Value	Unit	Temperature (K)	Source
η	[0.0022124; 0.0004490]	Pa×s	[267.01; 470.19]	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			-9.80444e+00
Coefficient B			9.85470e+02
Coefficient C			0.00000e+00
Coefficient D			0.00000e+00
Coefficient E			0.00000e+00
Temperature range, min.			267.01
Temperature range, max.			470.19
η	0.0022124	Pa×s	267.01	Calculated Property
η	0.0016592	Pa×s	289.59	Calculated Property
η	0.0012972	Pa×s	312.16	Calculated Property
η	0.0010485	Pa×s	334.74	Calculated Property
η	0.0008705	Pa×s	357.31	Calculated Property
η	0.0007389	Pa×s	379.89	Calculated Property
η	0.0006388	Pa×s	402.47	Calculated Property
η	0.0005609	Pa×s	425.04	Calculated Property
η	0.0004990	Pa×s	447.62	Calculated Property
η	0.0004490	Pa×s	470.19	Calculated Property

Similar Compounds

Find more compounds similar to Cyclopropane-1,2-dicarboxylic acid dimethyl ester, E.

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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