Chemical Properties of Glutaric acid, isobutyl 2-nitro-3-chlorobenzyl ester

Glutaric acid, isobutyl 2-nitro-3-chlorobenzyl ester

InChI
InChI=1S/C16H20ClNO6/c1-11(2)9-23-14(19)7-4-8-15(20)24-10-12-5-3-6-13(17)16(12)18(21)22/h3,5-6,11H,4,7-10H2,1-2H3
InChI Key
OUYGRUSVHXNHNT-UHFFFAOYSA-N
Formula
C16H20ClNO6
SMILES
CC(C)COC(=O)CCCC(=O)OCc1cccc(Cl)c1[N+](=O)[O-]
Molecular Weight1
357.79
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Physical Properties

Property Value Unit Source
ΔfH°gas -783.84 kJ/mol Relay (1.0) Calculated Property
ΔfusH° 51.23 kJ/mol Joback Calculated Property
ΔvapH° 100.03 kJ/mol Relay (1.0) Calculated Property
logPoct/wat 3.661 Crippen Calculated Property
McVol 257.080 ml/mol McGowan Calculated Property
Inp [2558.00; 2558.00]   Show Hide
Inp 2558.00 NIST
Inp 2558.00 NIST

Cheméo can also estimate Normal Boiling Point Temperature, Normal melting (fusion) point, Critical Temperature, Critical Pressure, Critical Volume, Standard Gibbs free energy of formation, Acentric Factor, Ionization energy, Log10 of Water solubility in mol/l 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.

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas [766.99; 813.22] J/mol×K [907.59; 1132.99] Show Hide
Cp,gas 766.99 J/mol×K 907.59 Joback Calculated Property
Cp,gas 777.88 J/mol×K 945.16 Joback Calculated Property
Cp,gas 787.46 J/mol×K 982.72 Joback Calculated Property
Cp,gas 795.76 J/mol×K 1020.29 Joback Calculated Property
Cp,gas 802.81 J/mol×K 1057.86 Joback Calculated Property
Cp,gas 808.62 J/mol×K 1095.42 Joback Calculated Property
Cp,gas 813.22 J/mol×K 1132.99 Joback Calculated Property

Similar Compounds

Glutaric acid, 2-nitro-3-chlorobenzyl propyl ester. Succinic acid, 3-chloro-2-nitrobenzyl isobutyl ester. Glutaric acid, butyl 2-nitro-3-chlorobenzyl ester. Glutaric acid, 2-nitro-3-chlorobenzyl pentyl ester. Glutaric acid, 2-nitro-3-chlorobenzyl undecyl ester. Glutaric acid, heptyl 2-nitro-3-chlorobenzyl ester. Glutaric acid, decyl 2-nitro-3-chlorobenzyl ester. Glutaric acid, 2-nitro-3-chlorobenzyl tridecyl ester. Glutaric acid, 2-nitro-3-chlorobenzyl nonyl ester. Glutaric acid, 2-nitro-3-chlorobenzyl octyl ester. Glutaric acid, dodecyl 2-nitro-3-chlorobenzyl ester. Glutaric acid, hexyl 2-nitro-3-chlorobenzyl ester. Succinic acid, 3-chloro-2-nitrobenzyl pentyl ester. Succinic acid, butyl 3-chloro-2-nitrobenzyl ester. Glutaric acid, 2-methylhex-3-yl 2-nitro-3-chlorobenzyl ester.

Find more compounds similar to Glutaric acid, isobutyl 2-nitro-3-chlorobenzyl ester.

Sources

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