Chemical Properties of Succinic acid, di(4-fluoro-3-nitrobenzyl) ester

Succinic acid, di(4-fluoro-3-nitrobenzyl) ester

InChI
InChI=1S/C18H14F2N2O8/c19-13-3-1-11(7-15(13)21(25)26)9-29-17(23)5-6-18(24)30-10-12-2-4-14(20)16(8-12)22(27)28/h1-4,7-8H,5-6,9-10H2
InChI Key
ZASFUHMRRWFXHB-UHFFFAOYSA-N
Formula
C18H14F2N2O8
SMILES
O=C(CCC(=O)OCc1ccc(F)c([N+](=O)[O-])c1)OCc1ccc(F)c([N+](=O)[O-])c1
Molecular Weight1
424.31
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Physical Properties

Property Value Unit Source
ΔfusH° 66.52 kJ/mol Joback Calculated Property
log10WS -5.50 Relay (1.0) Calculated Property
logPoct/wat 3.348 Crippen Calculated Property
McVol 270.220 ml/mol McGowan Calculated Property
Inp [3395.00; 3395.00]   Show Hide
Inp 3395.00 NIST
Inp 3395.00 NIST
Tboil 661.54 K Relay (1.0) Calculated Property

Cheméo can also estimate Normal melting (fusion) point, 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 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.

Correlations

Property Value Unit Temperature (K) Source
Cp,gas [386.43; 821.57] J/mol×K [273.00; 1000.00] Joback Predicted correlation Show Hide
EquationY = A + B·T + C·T² + D·T³ + E·T⁴
Y is Cp,gas in J/mol×K, T in K
Coefficient A4.98940e+01
Coefficient B1.43072e+00
Coefficient C-7.50040e-04
Coefficient D9.10000e-08
Coefficient E0.00000e+00
Temperature range, min.273.00
Temperature range, max.1000.00
Cp,gas 386.43 J/mol×K 273.00 Calculated Property
Cp,gas 466.21 J/mol×K 353.78 Calculated Property
Cp,gas 537.45 J/mol×K 434.56 Calculated Property
Cp,gas 600.46 J/mol×K 515.33 Calculated Property
Cp,gas 655.51 J/mol×K 596.11 Calculated Property
Cp,gas 702.90 J/mol×K 676.89 Calculated Property
Cp,gas 742.92 J/mol×K 757.67 Calculated Property
Cp,gas 775.84 J/mol×K 838.44 Calculated Property
Cp,gas 801.96 J/mol×K 919.22 Calculated Property
Cp,gas 821.57 J/mol×K 1000.00 Calculated Property

Similar Compounds

Succinic acid, butyl 4-fluoro-3-nitrobenzyl ester. Succinic acid, 4-fluoro-3-nitrobenzyl isobutyl ester. Sebacic acid, ethyl 3-nitro-4-fluorobenzyl ester. Succinic acid, 4-fluoro-3-nitrobenzyl pentyl ester. Succinic acid, 4-fluoro-3-nitrobenzyl hexyl ester. Sebacic acid, 3-nitro-4-fluorobenzyl propyl ester. Sebacic acid, butyl 3-nitro-4-fluorobenzyl ester. Acetic acid, (4-fluoro-3-nitrophenyl)methyl ester. Sebacic acid, heptyl 3-nitro-4-fluorobenzyl ester. Sebacic acid, 3-nitro-4-fluorobenzyl pentyl ester. Sebacic acid, hexyl 3-nitro-4-fluorobenzyl ester. Succinic acid, di(3-nitrobenzyl) ester. Succinic acid, ethyl 3-nitrobenzyl ester. Sebacic acid, isobutyl 3-nitro-4-fluorobenzyl ester. Succinic acid, di(4-chloro-3-nitrobenzyl) ester.

Find more compounds similar to Succinic acid, di(4-fluoro-3-nitrobenzyl) ester.

Sources

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