Chemical Properties of Diethylmalonic acid, isobutyl 4-nitrophenyl ester

Diethylmalonic acid, isobutyl 4-nitrophenyl ester

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InChI
InChI=1S/C17H23NO6/c1-5-17(6-2,15(19)23-11-12(3)4)16(20)24-14-9-7-13(8-10-14)18(21)22/h7-10,12H,5-6,11H2,1-4H3
InChI Key
FXGHUCMDTBPPFP-UHFFFAOYSA-N
Formula
C17H23NO6
SMILES
CCC(CC)(C(=O)OCC(C)C)C(=O)Oc1ccc([N+](=O)[O-])cc1
Molecular Weight1
337.37
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Physical Properties

Property Value Unit Source
Δf -236.85 kJ/mol Joback Calculated Property
Δfgas -683.54 kJ/mol Joback Calculated Property
Δfus 39.44 kJ/mol Joback Calculated Property
Δvap 89.59 kJ/mol Joback Calculated Property
log10WS -4.58 Crippen Calculated Property
logPoct/wat 3.506 Crippen Calculated Property
McVol 258.930 ml/mol McGowan Calculated Property
Pc 1731.78 kPa Joback Calculated Property
Inp [2229.00; 2229.00]   Show Hide
Inp 2229.00 NIST
Inp 2229.00 NIST
Tboil 920.77 K Joback Calculated Property
Tc 1151.70 K Joback Calculated Property
Tfus 595.64 K Joback Calculated Property
Vc 0.993 m3/kmol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas [813.63; 871.51] J/mol×K [920.77; 1151.70] Show Hide
Cp,gas 813.63 J/mol×K 920.77 Joback Calculated Property
Cp,gas 826.16 J/mol×K 959.26 Joback Calculated Property
Cp,gas 837.46 J/mol×K 997.75 Joback Calculated Property
Cp,gas 847.59 J/mol×K 1036.24 Joback Calculated Property
Cp,gas 856.61 J/mol×K 1074.72 Joback Calculated Property
Cp,gas 864.57 J/mol×K 1113.21 Joback Calculated Property
Cp,gas 871.51 J/mol×K 1151.70 Joback Calculated Property

Similar Compounds

Diethylmalonic acid, 4-nitrophenyl propyl ester. Diethylmalonic acid, butyl 4-nitrophenyl ester. Diethylmalonic acid, isobutyl 3-nitrophenyl ester. Diethylmalonic acid, 4-nitrophenyl pentyl ester. Diethylmalonic acid, ethyl 4-nitrophenyl ester. Diethylmalonic acid, hexyl 4-nitrophenyl ester. Diethylmalonic acid, decyl 4-nitrophenyl ester. Diethylmalonic acid, 4-nitrophenyl octyl ester. Diethylmalonic acid, 4-nitrophenyl nonyl ester. Diethylmalonic acid, heptyl 4-nitrophenyl ester. Diethylmalonic acid, isobutyl 2-nitrophenyl ester. Diethylmalonic acid, 3-nitrophenyl propyl ester. Diethylmalonic acid, 4-bromophenyl isobutyl ester. Diethylmalonic acid, butyl 3-nitrophenyl ester. Diethylmalonic acid, isobutyl 4-methoxyphenyl ester.

Find more compounds similar to Diethylmalonic acid, isobutyl 4-nitrophenyl ester.

Sources

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