Chemical Properties of Sebacic acid, 3-methyl-2-nitrobenzyl propyl ester

Sebacic acid, 3-methyl-2-nitrobenzyl propyl ester

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InChI
InChI=1S/C21H31NO6/c1-3-15-27-19(23)13-8-6-4-5-7-9-14-20(24)28-16-18-12-10-11-17(2)21(18)22(25)26/h10-12H,3-9,13-16H2,1-2H3
InChI Key
ZYPMBCBPGSPSPW-UHFFFAOYSA-N
Formula
C21H31NO6
SMILES
CCCOC(=O)CCCCCCCCC(=O)OCc1cccc(C)c1[N+](=O)[O-]
Molecular Weight1
393.47
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Physical Properties

Property Value Unit Source
Δf -213.20 kJ/mol Joback Calculated Property
Δfgas -763.54 kJ/mol Joback Calculated Property
Δfus 60.34 kJ/mol Joback Calculated Property
Δvap 100.84 kJ/mol Joback Calculated Property
log10WS -6.64 Crippen Calculated Property
logPoct/wat 5.020 Crippen Calculated Property
McVol 315.290 ml/mol McGowan Calculated Property
Pc 1249.49 kPa Joback Calculated Property
Inp [2883.00; 2883.00]   Show Hide
Inp 2883.00 NIST
Inp 2883.00 NIST
Tboil 1020.94 K Joback Calculated Property
Tc 1250.92 K Joback Calculated Property
Tfus 665.82 K Joback Calculated Property
Vc 1.234 m3/kmol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas [1046.88; 1100.99] J/mol×K [1020.94; 1250.92] Show Hide
Cp,gas 1046.88 J/mol×K 1020.94 Joback Calculated Property
Cp,gas 1059.43 J/mol×K 1059.27 Joback Calculated Property
Cp,gas 1070.51 J/mol×K 1097.60 Joback Calculated Property
Cp,gas 1080.17 J/mol×K 1135.93 Joback Calculated Property
Cp,gas 1088.45 J/mol×K 1174.26 Joback Calculated Property
Cp,gas 1095.38 J/mol×K 1212.59 Joback Calculated Property
Cp,gas 1100.99 J/mol×K 1250.92 Joback Calculated Property

Similar Compounds

Sebacic acid, butyl 3-methyl-2-nitrobenzyl ester. Sebacic acid, 3-methyl-2-nitrobenzyl pentyl ester. Glutaric acid, 3-methyl-2-nitrobenzyl octyl ester. Glutaric acid, 3-methyl-2-nitrobenzyl undecyl ester. Glutaric acid, decyl 3-methyl-2-nitrobenzyl ester. Glutaric acid, dodecyl 3-methyl-2-nitrobenzyl ester. Glutaric acid, heptyl 3-methyl-2-nitrobenzyl ester. Glutaric acid, 3-methyl-2-nitrobenzyl nonyl ester. Sebacic acid, ethyl 3-methyl-2-nitrobenzyl ester. Glutaric acid, hexyl 3-methyl-2-nitrobenzyl ester. Glutaric acid, 3-methyl-2-nitrobenzyl propyl ester. Sebacic acid, isobutyl 3-methyl-2-nitrobenzyl ester. Glutaric acid, butyl 3-methyl-2-nitrobenzyl ester. Succinic acid, dodecyl 3-methyl-2-nitrobenzyl ester. Succinic acid, 3-methyl-2-nitrobenzyl undecyl ester.

Find more compounds similar to Sebacic acid, 3-methyl-2-nitrobenzyl propyl ester.

Sources

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