Chemical Properties of Succinic acid, 3-methylbut-2-yl 3-nitrophenyl ester

Succinic acid, 3-methylbut-2-yl 3-nitrophenyl ester

InChI
InChI=1S/C15H19NO6/c1-10(2)11(3)21-14(17)7-8-15(18)22-13-6-4-5-12(9-13)16(19)20/h4-6,9-11H,7-8H2,1-3H3
InChI Key
DVBBXHNIOZBFNH-UHFFFAOYSA-N
Formula
C15H19NO6
SMILES
CC(C)C(C)OC(=O)CCC(=O)Oc1cccc([N+](=O)[O-])c1
Molecular Weight1
309.32
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Physical Properties

Property Value Unit Source
ΔfusH° 41.31 kJ/mol Joback Calculated Property
IE 9.29 eV Relay (1.0) Calculated Property
log10WS -3.78 Relay (1.0) Calculated Property
logPoct/wat 2.868 Crippen Calculated Property
McVol 230.750 ml/mol McGowan Calculated Property
Inp [2313.00; 2313.00]   Show Hide
Inp 2313.00 NIST
Inp 2313.00 NIST
Tboil 611.82 K Relay (1.0) Calculated Property
Tfus 336.79 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 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 [691.49; 747.10] J/mol×K [841.86; 1067.70] Show Hide
Cp,gas 691.49 J/mol×K 841.86 Joback Calculated Property
Cp,gas 703.94 J/mol×K 879.50 Joback Calculated Property
Cp,gas 715.09 J/mol×K 917.14 Joback Calculated Property
Cp,gas 724.96 J/mol×K 954.78 Joback Calculated Property
Cp,gas 733.57 J/mol×K 992.42 Joback Calculated Property
Cp,gas 740.94 J/mol×K 1030.06 Joback Calculated Property
Cp,gas 747.10 J/mol×K 1067.70 Joback Calculated Property

Similar Compounds

Succinic acid, 2-methylpent-3-yl 3-nitrophenyl ester. Succinic acid, dec-2-yl 3-nitrophenyl ester. Succinic acid, hept-2-yl 3-nitrophenyl ester. Pimelic acid, 4-methyl-2-pentyl 3-nitrophenyl ester. Succinic acid, hex-4-yn-3-yl 3-nitrophenyl ester. Succinic acid, 2-ethylhexyl 3-nitrophenyl ester. Succinic acid, cyclohexylmethyl 3-nitrophenyl ester. Glutaric acid, 3-methylbut-2-yl 4-nitrophenyl ester. Sebacic acid, isobutyl 3-nitrophenyl ester. Pimelic acid, isobutyl 3-nitrophenyl ester. Glutaric acid, 3-methylbut-2-yl 2-nitrophenyl ester. Glutaric acid, isobutyl 3-nitrophenyl ester. Glutaric acid, 2-methylpent-3-yl 4-nitrophenyl ester. Sebacic acid, isohexyl 3-nitrophenyl ester. Glutaric acid, isohexyl 3-nitrophenyl ester.

Find more compounds similar to Succinic acid, 3-methylbut-2-yl 3-nitrophenyl ester.

Sources

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