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

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

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InChI
InChI=1S/C22H25NO6/c1-3-4-5-8-13-28-21(24)18-9-6-7-10-19(18)22(25)29-15-17-12-11-16(2)20(14-17)23(26)27/h6-7,9-12,14H,3-5,8,13,15H2,1-2H3
InChI Key
LYGODNUNLQACDL-UHFFFAOYSA-N
Formula
C22H25NO6
SMILES
CCCCCCOC(=O)c1ccccc1C(=O)OCc1ccc(C)c([N+](=O)[O-])c1
Molecular Weight1
399.44
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Physical Properties

Property Value Unit Source
Δf -102.00 kJ/mol Joback Calculated Property
Δfgas -559.12 kJ/mol Joback Calculated Property
Δfus 56.59 kJ/mol Joback Calculated Property
Δvap 106.01 kJ/mol Joback Calculated Property
log10WS -7.29 Crippen Calculated Property
logPoct/wat 4.997 Crippen Calculated Property
McVol 305.620 ml/mol McGowan Calculated Property
Pc 1469.10 kPa Joback Calculated Property
Inp [3366.00; 3366.00]   Show Hide
Inp 3366.00 NIST
Inp 3366.00 NIST
Tboil 1075.48 K Joback Calculated Property
Tc 1322.27 K Joback Calculated Property
Tfus 716.03 K Joback Calculated Property
Vc 1.181 m3/kmol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas [991.18; 1026.61] J/mol×K [1075.48; 1322.27] Show Hide
Cp,gas 991.18 J/mol×K 1075.48 Joback Calculated Property
Cp,gas 1000.77 J/mol×K 1116.61 Joback Calculated Property
Cp,gas 1008.81 J/mol×K 1157.74 Joback Calculated Property
Cp,gas 1015.37 J/mol×K 1198.87 Joback Calculated Property
Cp,gas 1020.49 J/mol×K 1240.00 Joback Calculated Property
Cp,gas 1024.22 J/mol×K 1281.14 Joback Calculated Property
Cp,gas 1026.61 J/mol×K 1322.27 Joback Calculated Property

Similar Compounds

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

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

Sources

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