Chemical Properties of Benzofuran, 7-(2,4-dinitrophenoxy)-3-ethoxy-2,3-dihydro-2,2-dimethyl- (CAS 62059-46-5)

InChI

InChI=1S/C18H18N2O7/c1-4-25-17-12-6-5-7-15(16(12)27-18(17,2)3)26-14-9-8-11(19(21)22)10-13(14)20(23)24/h5-10,17H,4H2,1-3H3

InChI Key

NQDMYVDQNBMUIS-UHFFFAOYSA-N

Formula

C18H18N2O7

SMILES

CCOC1c2cccc(Oc3ccc([N+](=O)[O-])cc3[N+](=O)[O-])c2OC1(C)C

Molecular Weight¹

374.34

CAS

62059-46-5

• C_p,gas : Ideal gas heat capacity (J/mol×K).
• Δ_fusH° : Enthalpy of fusion at standard conditions (kJ/mol).
• IE : Ionization energy (eV).
• logP_oct/wat : Octanol/Water partition coefficient.
• McVol : McGowan's characteristic volume (ml/mol).
• 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, 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	[866.50; 987.63]	J/mol×K	[1062.30; 1332.11]
Cp,gas	866.50	J/mol×K	1062.30	Joback Calculated Property
Cp,gas	884.77	J/mol×K	1107.27	Joback Calculated Property
Cp,gas	903.48	J/mol×K	1152.24	Joback Calculated Property
Cp,gas	922.88	J/mol×K	1197.20	Joback Calculated Property
Cp,gas	943.21	J/mol×K	1242.17	Joback Calculated Property
Cp,gas	964.71	J/mol×K	1287.14	Joback Calculated Property
Cp,gas	987.63	J/mol×K	1332.11	Joback Calculated Property

Similar Compounds

Find more compounds similar to Benzofuran, 7-(2,4-dinitrophenoxy)-3-ethoxy-2,3-dihydro-2,2-dimethyl-.

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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