Chemical Properties of Phthalic acid, 4-methyl-3-nitrobenzyl pentyl ester

Phthalic acid, 4-methyl-3-nitrobenzyl pentyl ester

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InChI
InChI=1S/C21H23NO6/c1-3-4-7-12-27-20(23)17-8-5-6-9-18(17)21(24)28-14-16-11-10-15(2)19(13-16)22(25)26/h5-6,8-11,13H,3-4,7,12,14H2,1-2H3
InChI Key
QXWIOUCPQXLAFS-UHFFFAOYSA-N
Formula
C21H23NO6
SMILES
CCCCCOC(=O)c1ccccc1C(=O)OCc1ccc(C)c([N+](=O)[O-])c1
Molecular Weight1
385.41
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Physical Properties

Property Value Unit Source
Δf -110.42 kJ/mol Joback Calculated Property
Δfgas -538.48 kJ/mol Joback Calculated Property
Δfus 54.00 kJ/mol Joback Calculated Property
Δvap 103.78 kJ/mol Joback Calculated Property
log10WS -6.87 Crippen Calculated Property
logPoct/wat 4.607 Crippen Calculated Property
McVol 291.530 ml/mol McGowan Calculated Property
Pc 1583.49 kPa Joback Calculated Property
Inp [3258.00; 3258.00]   Show Hide
Inp 3258.00 NIST
Inp 3258.00 NIST
Tboil 1052.60 K Joback Calculated Property
Tc 1298.25 K Joback Calculated Property
Tfus 704.76 K Joback Calculated Property
Vc 1.125 m3/kmol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas [932.47; 968.60] J/mol×K [1052.60; 1298.25] Show Hide
Cp,gas 932.47 J/mol×K 1052.60 Joback Calculated Property
Cp,gas 942.10 J/mol×K 1093.54 Joback Calculated Property
Cp,gas 950.22 J/mol×K 1134.48 Joback Calculated Property
Cp,gas 956.89 J/mol×K 1175.42 Joback Calculated Property
Cp,gas 962.15 J/mol×K 1216.37 Joback Calculated Property
Cp,gas 966.03 J/mol×K 1257.31 Joback Calculated Property
Cp,gas 968.60 J/mol×K 1298.25 Joback Calculated Property

Similar Compounds

Phthalic acid, hexyl 4-methyl-3-nitrobenzyl ester. Phthalic acid, decyl 4-methyl-3-nitrobenzyl ester. Phthalic acid, 4-methyl-3-nitrobenzyl octyl ester. Phthalic acid, heptyl 4-methyl-3-nitrobenzyl ester. Phthalic acid, 4-methyl-3-nitrobenzyl nonyl ester. Phthalic acid, 3,5-dinitro-4-methylbenzyl pentyl ester. Phthalic acid, 3,5-dinitro-4-methylbenzyl hexyl ester. Phthalic acid, 3,5-dinitro-4-methylbenzyl heptyl ester. Phthalic acid, butyl 3,5-dinitro-4-methylbenzyl ester. Phthalic acid, 4-methyl-3-nitrobenzyl propyl ester. Phthalic acid, isobutyl 4-methyl-3-nitrobenzyl ester. Terephthalic acid, 2-nitrobenzyl pentyl ester. Phthalic acid, 3,5-dinitro-4-methylbenzyl propyl ester. Terephthalic acid, 4-nitro-3-methylbenzyl pentyl ester. Terephthalic acid, hexyl 4-nitro-3-methylbenzyl ester.

Find more compounds similar to Phthalic acid, 4-methyl-3-nitrobenzyl pentyl ester.

Sources

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