Chemical Properties of Isopropyl 3-formyl-2,4-dihydroxy-6-methylbenzoate

InChI

InChI=1S/C12H14O5/c1-6(2)17-12(16)10-7(3)4-9(14)8(5-13)11(10)15/h4-6,14-15H,1-3H3

InChI Key

BECXOCBQWLOZFB-UHFFFAOYSA-N

Formula

C12H14O5

SMILES

Cc1cc(O)c(C=O)c(O)c1C(=O)OC(C)C

Molecular Weight¹

238.24

• 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).
• I_np : Non-polar retention indices.
• T_fus : Normal melting (fusion) point (K).
• ¹: Molecular weight from the IUPAC atomic weights tables.

Physical Properties

Cheméo can also estimate Normal Boiling Point Temperature, 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, 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.

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[501.27; 559.90]	J/mol×K	[778.48; 1007.53]
Cp,gas	501.27	J/mol×K	778.48	Joback Calculated Property
Cp,gas	511.94	J/mol×K	816.65	Joback Calculated Property
Cp,gas	522.11	J/mol×K	854.83	Joback Calculated Property
Cp,gas	531.89	J/mol×K	893.00	Joback Calculated Property
Cp,gas	541.38	J/mol×K	931.18	Joback Calculated Property
Cp,gas	550.68	J/mol×K	969.35	Joback Calculated Property
Cp,gas	559.90	J/mol×K	1007.53	Joback Calculated Property
η	[0.0000007; 0.0000200]	Pa×s	[569.23; 778.48]
η	0.0000200	Pa×s	569.23	Joback Calculated Property
η	0.0000098	Pa×s	604.11	Joback Calculated Property
η	0.0000052	Pa×s	638.98	Joback Calculated Property
η	0.0000029	Pa×s	673.86	Joback Calculated Property
η	0.0000018	Pa×s	708.73	Joback Calculated Property
η	0.0000011	Pa×s	743.61	Joback Calculated Property
η	0.0000007	Pa×s	778.48	Joback Calculated Property

Similar Compounds

Find more compounds similar to Isopropyl 3-formyl-2,4-dihydroxy-6-methylbenzoate.

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

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.
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