Chemical Properties of Isophthalic acid, 2-isopropylphenyl propyl ester

InChI

InChI=1S/C20H22O4/c1-4-12-23-19(21)15-8-7-9-16(13-15)20(22)24-18-11-6-5-10-17(18)14(2)3/h5-11,13-14H,4,12H2,1-3H3

InChI Key

MAGCTMZUBYWKRO-UHFFFAOYSA-N

Formula

C20H22O4

SMILES

CCCOC(=O)c1cccc(C(=O)Oc2ccccc2C(C)C)c1

Molecular Weight¹

326.39

• ω : Acentric Factor.
• 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).
• P_c : Critical Pressure (kPa).
• T_boil : Normal Boiling Point Temperature (K).
• T_c : Critical Temperature (K).
• T_fus : Normal melting (fusion) point (K).
• V_c : Critical Volume (m³/kmol).
• ¹: Molecular weight from the IUPAC atomic weights tables.

Physical Properties

Cheméo can also estimate Enthalpy of formation at standard conditions, Enthalpy of vaporization at standard conditions, Standard Gibbs free energy of formation, 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.

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[770.90; 838.20]	J/mol×K	[836.52; 1060.34]
Cp,gas	770.90	J/mol×K	836.52	Joback Calculated Property
Cp,gas	785.54	J/mol×K	873.82	Joback Calculated Property
Cp,gas	798.77	J/mol×K	911.13	Joback Calculated Property
Cp,gas	810.61	J/mol×K	948.43	Joback Calculated Property
Cp,gas	821.11	J/mol×K	985.73	Joback Calculated Property
Cp,gas	830.29	J/mol×K	1023.04	Joback Calculated Property
Cp,gas	838.20	J/mol×K	1060.34	Joback Calculated Property
η	[0.0000401; 0.0007089]	Pa×s	[462.70; 836.52]
η	0.0007089	Pa×s	462.70	Joback Calculated Property
η	0.0003305	Pa×s	525.00	Joback Calculated Property
η	0.0001812	Pa×s	587.31	Joback Calculated Property
η	0.0001115	Pa×s	649.61	Joback Calculated Property
η	0.0000746	Pa×s	711.91	Joback Calculated Property
η	0.0000533	Pa×s	774.22	Joback Calculated Property
η	0.0000401	Pa×s	836.52	Joback Calculated Property

Similar Compounds

Find more compounds similar to Isophthalic acid, 2-isopropylphenyl propyl ester.

Sources

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

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