Chemical Properties of Succinic acid, 2-methylpent-3-yl 3-nitrobenzyl ester

Succinic acid, 2-methylpent-3-yl 3-nitrobenzyl ester

InChI
InChI=1S/C17H23NO6/c1-4-15(12(2)3)24-17(20)9-8-16(19)23-11-13-6-5-7-14(10-13)18(21)22/h5-7,10,12,15H,4,8-9,11H2,1-3H3
InChI Key
XQQIAENMOFJJON-UHFFFAOYSA-N
Formula
C17H23NO6
SMILES
CCC(OC(=O)CCC(=O)OCc1cccc([N+](=O)[O-])c1)C(C)C
Molecular Weight1
337.37
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Physical Properties

Property Value Unit Source
ΔfusH° 46.49 kJ/mol Joback Calculated Property
IE 9.34 eV Relay (1.0) Calculated Property
logPoct/wat 3.396 Crippen Calculated Property
McVol 258.930 ml/mol McGowan Calculated Property
Inp [2513.00; 2513.00]   Show Hide
Inp 2513.00 NIST
Inp 2513.00 NIST
Tboil 629.62 K Relay (1.0) Calculated Property
Tfus 298.87 K Relay (1.0) Calculated Property

Cheméo can also estimate 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 [804.21; 860.16] J/mol×K [887.62; 1109.84] Show Hide
Cp,gas 804.21 J/mol×K 887.62 Joback Calculated Property
Cp,gas 816.82 J/mol×K 924.66 Joback Calculated Property
Cp,gas 828.08 J/mol×K 961.69 Joback Calculated Property
Cp,gas 838.02 J/mol×K 998.73 Joback Calculated Property
Cp,gas 846.65 J/mol×K 1035.76 Joback Calculated Property
Cp,gas 854.03 J/mol×K 1072.80 Joback Calculated Property
Cp,gas 860.16 J/mol×K 1109.84 Joback Calculated Property

Similar Compounds

Succinic acid, 2-methylhex-3-yl 3-nitrobenzyl ester. Glutaric acid, 2-methylhex-3-yl 3-nitrobenzyl ester. Succinic acid, 3-methylbut-2-yl 3-nitrobenzyl ester. Succinic acid, 3,5-dinitrobenzyl 2-methylhex-3-yl ester. Succinic acid, dec-2-yl 3-nitrobenzyl ester. Succinic acid, hept-2-yl 3-nitrobenzyl ester. Glutaric acid, 3-methylbut-2-yl 3-nitrobenzyl ester. Succinic acid, 2-ethylhexyl 3-nitrobenzyl ester. Succinic acid, 2-methylhex-3-yl 4-methyl-3-nitrobenzyl ester. Glutaric acid, 3,5-dinitrobenzyl 2-methylhex-3-yl ester. Succinic acid, cyclohexylmethyl 3-nitrobenzyl ester. Succinic acid, 4-fluoro-3-nitrobenzyl 2-methylhex-3-yl ester. Glutaric acid, dec-2-yl 3-nitrobenzyl ester. Glutaric acid, 2-methylhex-3-yl 4-methyl-3-nitrobenzyl ester. Glutaric acid, 2-ethylhexyl 3-nitrobenzyl ester.

Find more compounds similar to Succinic acid, 2-methylpent-3-yl 3-nitrobenzyl ester.

Sources

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