Chemical Properties of Succinic acid, 3,5-dimethylphenyl 2-methoxyethyl ester

InChI

InChI=1S/C15H20O5/c1-11-8-12(2)10-13(9-11)20-15(17)5-4-14(16)19-7-6-18-3/h8-10H,4-7H2,1-3H3

InChI Key

PKFZAKXEWBDWPA-UHFFFAOYSA-N

Formula

C15H20O5

SMILES

COCCOC(=O)CCC(=O)Oc1cc(C)cc(C)c1

Molecular Weight¹

280.32

• 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).
• 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.
• ¹: Molecular weight from the IUPAC atomic weights tables.

Physical Properties

Property	Value	Unit	Source
ΔfusH°	37.79	kJ/mol	Joback Calculated Property
log10WS	-3.01		Relay (1.0) Calculated Property
logPoct/wat	2.179		Crippen Calculated Property
McVol	219.200	ml/mol	McGowan Calculated Property
Inp	[2098.00; 2098.00]
Inp	2098.00		NIST
Inp	2098.00		NIST

Cheméo can also estimate Normal Boiling Point Temperature, Normal melting (fusion) point, 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, 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	[319.61; 703.30]	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			6.02640e+01
Coefficient B			1.05816e+00
Coefficient C			-3.89120e-04
Coefficient D			-2.60000e-08
Coefficient E			0.00000e+00
Temperature range, min.			273.00
Temperature range, max.			1000.00
Cp,gas	319.61	J/mol×K	273.00	Calculated Property
Cp,gas	384.76	J/mol×K	353.78	Calculated Property
Cp,gas	444.48	J/mol×K	434.56	Calculated Property
Cp,gas	498.67	J/mol×K	515.33	Calculated Property
Cp,gas	547.26	J/mol×K	596.11	Calculated Property
Cp,gas	590.17	J/mol×K	676.89	Calculated Property
Cp,gas	627.31	J/mol×K	757.67	Calculated Property
Cp,gas	658.60	J/mol×K	838.44	Calculated Property
Cp,gas	683.96	J/mol×K	919.22	Calculated Property
Cp,gas	703.30	J/mol×K	1000.00	Calculated Property

Property	Value	Unit	Temperature (K)	Source
η	[0.0008404; 0.0000982]	Pa×s	[417.16; 642.23]	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			-1.32071e+01
Coefficient B			2.55527e+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.			417.16
Temperature range, max.			642.23
η	0.0008404	Pa×s	417.16	Calculated Property
η	0.0005943	Pa×s	442.17	Calculated Property
η	0.0004362	Pa×s	467.18	Calculated Property
η	0.0003303	Pa×s	492.18	Calculated Property
η	0.0002570	Pa×s	517.19	Calculated Property
η	0.0002046	Pa×s	542.20	Calculated Property
η	0.0001662	Pa×s	567.21	Calculated Property
η	0.0001374	Pa×s	592.21	Calculated Property
η	0.0001154	Pa×s	617.22	Calculated Property
η	0.0000982	Pa×s	642.23	Calculated Property

Similar Compounds

Find more compounds similar to Succinic acid, 3,5-dimethylphenyl 2-methoxyethyl ester.

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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