Chemical Properties of 2-(2-Ethoxyethoxy)ethyl 3,5-dinitrobenzoate

2-(2-Ethoxyethoxy)ethyl 3,5-dinitrobenzoate

InChI
InChI=1S/C13H16N2O8/c1-2-21-3-4-22-5-6-23-13(16)10-7-11(14(17)18)9-12(8-10)15(19)20/h7-9H,2-6H2,1H3
InChI Key
IBROIYRFSMWSLH-UHFFFAOYSA-N
Formula
C13H16N2O8
SMILES
CCOCCOCCOC(=O)c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1
Molecular Weight1
328.27
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Physical Properties

Property Value Unit Source
ΔfusH° 52.16 kJ/mol Joback Calculated Property
log10WS -3.29 Relay (1.0) Calculated Property
logPoct/wat 1.713 Crippen Calculated Property
McVol 224.290 ml/mol McGowan Calculated Property
Pc 2123.64 kPa Joback Calculated Property
Inp [2376.00; 2376.00]   Show Hide
Inp 2376.00 NIST
Inp 2376.00 NIST
Tboil 628.75 K Relay (1.0) Calculated Property
Tc 903.49 K Relay (1.0) Calculated Property
Tfus 294.77 K Relay (1.0) Calculated Property

Cheméo can also estimate 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.

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas [689.88; 723.28] J/mol×K [940.42; 1178.54] Show Hide
Cp,gas 689.88 J/mol×K 940.42 Joback Calculated Property
Cp,gas 698.95 J/mol×K 980.11 Joback Calculated Property
Cp,gas 706.63 J/mol×K 1019.79 Joback Calculated Property
Cp,gas 712.90 J/mol×K 1059.48 Joback Calculated Property
Cp,gas 717.77 J/mol×K 1099.17 Joback Calculated Property
Cp,gas 721.23 J/mol×K 1138.85 Joback Calculated Property
Cp,gas 723.28 J/mol×K 1178.54 Joback Calculated Property

Similar Compounds

2-Ethoxyethyl 3,5-dinitrobenzoate. 2-(2-Methoxyethoxy)ethyl 3,5-dinitrobenzoate. Ethylene glycol bis(3,5-dinitrobenzoate). 2-Butoxyethyl 3,5-dinitrobenzoate. Ethyl 3,5-dinitrobenzoate. 2-Chloroethyl 3,5-dinitrobenzoate. 1-Butoxypropan-2-yl 3,5-dinitrobenzoate. Benzoic acid, 3,5-dinitro, 1-methylethyl ester. 2,2-Dichloroethyl 3,5-dinitrobenzoate. Benzoic acid, 3,5-dinitro, allyl ester. Benzoic acid, 3,5-dinitro, 2-propynyl ester. propyl 3,5-dinitrobenzoate. (E)-But-2-enyl 3,5-dinitrobenzoate. 2,2,2-Trichloroethyl 3,5-dinitrobenzoate. But-3-enyl 3,5-dinitrobenzoate.

Find more compounds similar to 2-(2-Ethoxyethoxy)ethyl 3,5-dinitrobenzoate.

Sources

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